Quaternary ammonium salts

Ammonium salts in which a nitrogen atom (with a +1 formal charge) has four carbon-nitrogen single bonds; this nitrogen could be bonded to four functional groups containing carbon.

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Benzalkonium Chloride (50% in Water), TCI America™

CAS: 63449-41-2 Molecular Formula: C21H38ClN Molecular Weight (g/mol): 339.99 MDL Number: MFCD00137276 InChI Key: JBIROUFYLSSYDX-UHFFFAOYSA-M Synonym: benzyldimethyldecylammonium chloride,benzenemethanaminium, n-decyl-n,n-dimethyl-, chloride,benzenemethanaminium, n-decyl-n,n-dimethyl-, chloride 1:1,quaternary ammonium compounds, benzyl-c8-18-alkyldimethyl, chlorides,roccal,benzyl decyl dimethylazanium chloride,tret-o-lite xc 511,ccris 4586,benzyl decyl dimethylammonium chloride,c8-18-alkydimethylbenzyl ammonium chlorides PubChem CID: 13762 IUPAC Name: benzyl(dodecyl)dimethylazanium chloride SMILES: [Cl-].CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1

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PubChem CID	13762
CAS	63449-41-2
Molecular Weight (g/mol)	339.99
MDL Number	MFCD00137276
SMILES	[Cl-].CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1
Synonym	benzyldimethyldecylammonium chloride,benzenemethanaminium, n-decyl-n,n-dimethyl-, chloride,benzenemethanaminium, n-decyl-n,n-dimethyl-, chloride 1:1,quaternary ammonium compounds, benzyl-c8-18-alkyldimethyl, chlorides,roccal,benzyl decyl dimethylazanium chloride,tret-o-lite xc 511,ccris 4586,benzyl decyl dimethylammonium chloride,c8-18-alkydimethylbenzyl ammonium chlorides
IUPAC Name	benzyl(dodecyl)dimethylazanium chloride
InChI Key	JBIROUFYLSSYDX-UHFFFAOYSA-M
Molecular Formula	C21H38ClN

Tetra-n-butylammonium sulfate, 50% w/w aq. soln.

CAS: 2472-88-0 Molecular Formula: C32H72N2O4S Molecular Weight (g/mol): 581.00 MDL Number: MFCD00216632 InChI Key: ZXUCBXRTRRIBSO-UHFFFAOYSA-L Synonym: bis tetrabutylammonium sulphate,tetrabutylammonium sulfate,tetrabutylammonium sulfate solution,1-butanaminium, n,n,n-tributyl-, sulfate 2:1,tetrabutyl ammoniumsulfat,tetrabutylammonium sulphate,acmc-1cdo3,tetrabutyl ammonium sulfate,tetrabutyl-ammonium sulfate,tetra-n-butylammonium sulfate PubChem CID: 11433187 IUPAC Name: tetrabutylazanium;sulfate SMILES: [O-]S([O-])(=O)=O.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC

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PubChem CID	11433187
CAS	2472-88-0
Molecular Weight (g/mol)	581.00
MDL Number	MFCD00216632
SMILES	[O-]S([O-])(=O)=O.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC
Synonym	bis tetrabutylammonium sulphate,tetrabutylammonium sulfate,tetrabutylammonium sulfate solution,1-butanaminium, n,n,n-tributyl-, sulfate 2:1,tetrabutyl ammoniumsulfat,tetrabutylammonium sulphate,acmc-1cdo3,tetrabutyl ammonium sulfate,tetrabutyl-ammonium sulfate,tetra-n-butylammonium sulfate
IUPAC Name	tetrabutylazanium;sulfate
InChI Key	ZXUCBXRTRRIBSO-UHFFFAOYSA-L
Molecular Formula	C32H72N2O4S

Tetrabutylammonium Bromide 99.0+%, TCI America™

CAS: 1643-19-2 Molecular Formula: C16H36BrN Molecular Weight (g/mol): 322.375 MDL Number: MFCD00011633 InChI Key: JRMUNVKIHCOMHV-UHFFFAOYSA-M Synonym: tetrabutylammonium bromide,tetra-n-butylammonium bromide,tbab,tetrabutylazanium bromide,tetrabutyl ammonium bromide,tetrabutyl-ammonium bromide,aliquat 100,tbabr,ipc-tba-br,unii-vjz168i98r PubChem CID: 74236 ChEBI: CHEBI:51993 IUPAC Name: tetrabutylazanium;bromide SMILES: CCCC[N+](CCCC)(CCCC)CCCC.[Br-]

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PubChem CID	74236
CAS	1643-19-2
Molecular Weight (g/mol)	322.375
ChEBI	CHEBI:51993
MDL Number	MFCD00011633
SMILES	CCCC[N+](CCCC)(CCCC)CCCC.[Br-]
Synonym	tetrabutylammonium bromide,tetra-n-butylammonium bromide,tbab,tetrabutylazanium bromide,tetrabutyl ammonium bromide,tetrabutyl-ammonium bromide,aliquat 100,tbabr,ipc-tba-br,unii-vjz168i98r
IUPAC Name	tetrabutylazanium;bromide
InChI Key	JRMUNVKIHCOMHV-UHFFFAOYSA-M
Molecular Formula	C16H36BrN

Choline Chloride 98.0+%, TCI America™

CAS: 67-48-1 Molecular Formula: C5H14ClNO Molecular Weight (g/mol): 139.62 MDL Number: MFCD00011721 InChI Key: SGMZJAMFUVOLNK-UHFFFAOYSA-M Synonym: choline chloride,hepacholine,biocolina,biocoline,lipotril,paresan,luridin chloride,choline hydrochloride,cholinium chloride,bilineurin chloride PubChem CID: 6209 ChEBI: CHEBI:133341 IUPAC Name: (2-hydroxyethyl)trimethylazanium chloride SMILES: [Cl-].C[N+](C)(C)CCO

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PubChem CID	6209
CAS	67-48-1
Molecular Weight (g/mol)	139.62
ChEBI	CHEBI:133341
MDL Number	MFCD00011721
SMILES	[Cl-].C[N+](C)(C)CCO
Synonym	choline chloride,hepacholine,biocolina,biocoline,lipotril,paresan,luridin chloride,choline hydrochloride,cholinium chloride,bilineurin chloride
IUPAC Name	(2-hydroxyethyl)trimethylazanium chloride
InChI Key	SGMZJAMFUVOLNK-UHFFFAOYSA-M
Molecular Formula	C5H14ClNO

Tetramethylammonium Acetate 98.0+%, TCI America™

CAS: 10581-12-1 Molecular Formula: C6H15NO2 Molecular Weight (g/mol): 133.19 MDL Number: MFCD00011630 InChI Key: MRYQZMHVZZSQRT-UHFFFAOYSA-M Synonym: tetramethylammonium acetate,methanaminium, n,n,n-trimethyl-, acetate,tetramethyl ammonium acetate,methanaminium, n,n,n-trimethyl-, acetate 1:1,tetramethylammonium ion acetate,ammonium, tetramethyl-, acetate,tetramethylazanium acetate,n,n,n-trimethyl-methanaminiuacetate,acetate ion; tetramethylammonium ion PubChem CID: 82741 IUPAC Name: tetramethylazanium acetate SMILES: CC([O-])=O.C[N+](C)(C)C

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PubChem CID	82741
CAS	10581-12-1
Molecular Weight (g/mol)	133.19
MDL Number	MFCD00011630
SMILES	CC([O-])=O.C[N+](C)(C)C
Synonym	tetramethylammonium acetate,methanaminium, n,n,n-trimethyl-, acetate,tetramethyl ammonium acetate,methanaminium, n,n,n-trimethyl-, acetate 1:1,tetramethylammonium ion acetate,ammonium, tetramethyl-, acetate,tetramethylazanium acetate,n,n,n-trimethyl-methanaminiuacetate,acetate ion; tetramethylammonium ion
IUPAC Name	tetramethylazanium acetate
InChI Key	MRYQZMHVZZSQRT-UHFFFAOYSA-M
Molecular Formula	C6H15NO2

Tetraethylammonium Bromide 98.0+%, TCI America™

CAS: 71-91-0 Molecular Formula: C8H20BrN Molecular Weight (g/mol): 210.159 MDL Number: MFCD00011825 InChI Key: HWCKGOZZJDHMNC-UHFFFAOYSA-M Synonym: tetraethylammonium bromide,teab,tea bromide,tetrylammonium bromide,sympatektoman,tetranium,etylon,bromethyl,beparon,etambro PubChem CID: 6285 IUPAC Name: tetraethylazanium;bromide SMILES: CC[N+](CC)(CC)CC.[Br-]

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PubChem CID	6285
CAS	71-91-0
Molecular Weight (g/mol)	210.159
MDL Number	MFCD00011825
SMILES	CC[N+](CC)(CC)CC.[Br-]
Synonym	tetraethylammonium bromide,teab,tea bromide,tetrylammonium bromide,sympatektoman,tetranium,etylon,bromethyl,beparon,etambro
IUPAC Name	tetraethylazanium;bromide
InChI Key	HWCKGOZZJDHMNC-UHFFFAOYSA-M
Molecular Formula	C8H20BrN

Tetramethylammonium hexafluorophosphate, 99%

CAS: 558-32-7 Molecular Formula: C4H12F6NP Molecular Weight (g/mol): 219.111 MDL Number: MFCD00012012 InChI Key: ZFKULDQWLXAKIM-UHFFFAOYSA-N Synonym: tetramethylammonium hexafluorophosphate,ammonium, tetramethyl-, hexafluorophosphate 1-,tetramethylazanium hexafluorophosphate,c4h12n.f6p,acmc-209lpp,hexafluoro-$l^ 5-phosphanuide; tetramethylammonium ion,methanaminium, n,n,n-trimethyl-, hexafluorophosphate 1-,methanaminium, n,n,n-trimethyl-, hexafluorophosphate 1-9ci PubChem CID: 11209 IUPAC Name: tetramethylazanium;hexafluorophosphate SMILES: C[N+](C)(C)C.F[P-](F)(F)(F)(F)F

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PubChem CID	11209
CAS	558-32-7
Molecular Weight (g/mol)	219.111
MDL Number	MFCD00012012
SMILES	C[N+](C)(C)C.F[P-](F)(F)(F)(F)F
Synonym	tetramethylammonium hexafluorophosphate,ammonium, tetramethyl-, hexafluorophosphate 1-,tetramethylazanium hexafluorophosphate,c4h12n.f6p,acmc-209lpp,hexafluoro-$l^ 5-phosphanuide; tetramethylammonium ion,methanaminium, n,n,n-trimethyl-, hexafluorophosphate 1-,methanaminium, n,n,n-trimethyl-, hexafluorophosphate 1-9ci
IUPAC Name	tetramethylazanium;hexafluorophosphate
InChI Key	ZFKULDQWLXAKIM-UHFFFAOYSA-N
Molecular Formula	C4H12F6NP

Tetra-n-hexylammonium iodide, 99%

CAS: 2138-24-1 Molecular Formula: C24H52IN Molecular Weight (g/mol): 481.591 MDL Number: MFCD00041981 InChI Key: VRKHAMWCGMJAMI-UHFFFAOYSA-M Synonym: tetrahexylammonium iodide,tetra-n-hexylammonium iodide,1-hexanaminium, n,n,n-trihexyl-, iodide,tetrahexylazanium iodide,1-hexanaminium, n,n,n-trihexyl-, iodide 1:1,acmc-209fjk,tetrahexyl ammonium iodide,tetra-n-hexyl ammonium iodide,ammonium, tetrahexyl-, iodide,1-hexanaminium,n,n-trihexyl-, iodide PubChem CID: 75056 IUPAC Name: tetrahexylazanium;iodide SMILES: CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[I-]

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PubChem CID	75056
CAS	2138-24-1
Molecular Weight (g/mol)	481.591
MDL Number	MFCD00041981
SMILES	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[I-]
Synonym	tetrahexylammonium iodide,tetra-n-hexylammonium iodide,1-hexanaminium, n,n,n-trihexyl-, iodide,tetrahexylazanium iodide,1-hexanaminium, n,n,n-trihexyl-, iodide 1:1,acmc-209fjk,tetrahexyl ammonium iodide,tetra-n-hexyl ammonium iodide,ammonium, tetrahexyl-, iodide,1-hexanaminium,n,n-trihexyl-, iodide
IUPAC Name	tetrahexylazanium;iodide
InChI Key	VRKHAMWCGMJAMI-UHFFFAOYSA-M
Molecular Formula	C24H52IN

S-Acetylthiocholine iodide, 98%

CAS: 1866-15-5 MDL Number: MFCD00011819 InChI Key: NTBLZMAMTZXLBP-UHFFFAOYSA-M Synonym: acetylthiocholine iodide,s-acetylthiocholine iodide,acetylthiocholine diiodide,2-acetylthioethyltrimethylammonium iodide,2-acetylthio-n,n,n-trimethylethanaminium iodide,ethanaminium, 2-acetylthio-n,n,n-trimethyl-, iodide,acetylthiocholinjodid,choline, s-acetylthio-, iodide,2-acetylsulfanyl-n,n,n-trimethylethanaminium iodide,acetyl thiobilineurine iodide PubChem CID: 74629 IUPAC Name: 2-acetylsulfanylethyl(trimethyl)azanium;iodide SMILES: CC(=O)SCC[N+](C)(C)C.[I-]

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PubChem CID	74629
CAS	1866-15-5
MDL Number	MFCD00011819
SMILES	CC(=O)SCC[N+](C)(C)C.[I-]
Synonym	acetylthiocholine iodide,s-acetylthiocholine iodide,acetylthiocholine diiodide,2-acetylthioethyltrimethylammonium iodide,2-acetylthio-n,n,n-trimethylethanaminium iodide,ethanaminium, 2-acetylthio-n,n,n-trimethyl-, iodide,acetylthiocholinjodid,choline, s-acetylthio-, iodide,2-acetylsulfanyl-n,n,n-trimethylethanaminium iodide,acetyl thiobilineurine iodide
IUPAC Name	2-acetylsulfanylethyl(trimethyl)azanium;iodide
InChI Key	NTBLZMAMTZXLBP-UHFFFAOYSA-M

Choline Chloride, BAKER ANALYZED™ Reagent, J.T. Baker™

CAS: 67-48-1 Molecular Formula: C5H14ClNO Molecular Weight (g/mol): 139.62 MDL Number: MFCD00011721 InChI Key: SGMZJAMFUVOLNK-UHFFFAOYSA-M Synonym: choline chloride,hepacholine,biocolina,biocoline,lipotril,paresan,luridin chloride,choline hydrochloride,cholinium chloride,bilineurin chloride PubChem CID: 6209 ChEBI: CHEBI:133341 IUPAC Name: 2-hydroxyethyl(trimethyl)azanium;chloride SMILES: [Cl-].C[N+](C)(C)CCO

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PubChem CID	6209
CAS	67-48-1
Molecular Weight (g/mol)	139.62
ChEBI	CHEBI:133341
MDL Number	MFCD00011721
SMILES	[Cl-].C[N+](C)(C)CCO
Synonym	choline chloride,hepacholine,biocolina,biocoline,lipotril,paresan,luridin chloride,choline hydrochloride,cholinium chloride,bilineurin chloride
IUPAC Name	2-hydroxyethyl(trimethyl)azanium;chloride
InChI Key	SGMZJAMFUVOLNK-UHFFFAOYSA-M
Molecular Formula	C5H14ClNO

Acetylcholine Chloride Crystalline MP Biomedicals

CAS: 60-31-1 Molecular Formula: C7H16ClNO2 Molecular Weight (g/mol): 181.66 InChI Key: JUGOREOARAHOCO-UHFFFAOYSA-M Synonym: acetylcholine chloride,miochol,acecoline,chloroacetylcholine,arterocoline,acecholin,ovisot,ach chloride,azetylcholinchlorid,2-acetyloxy-n,n,n-trimethylethanaminium chloride PubChem CID: 6060 ChEBI: CHEBI:2417 IUPAC Name: 2-acetyloxyethyl(trimethyl)azanium;chloride SMILES: CC(=O)OCC[N+](C)(C)C.[Cl-]

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PubChem CID	6060
CAS	60-31-1
Molecular Weight (g/mol)	181.66
ChEBI	CHEBI:2417
SMILES	CC(=O)OCC[N+](C)(C)C.[Cl-]
Synonym	acetylcholine chloride,miochol,acecoline,chloroacetylcholine,arterocoline,acecholin,ovisot,ach chloride,azetylcholinchlorid,2-acetyloxy-n,n,n-trimethylethanaminium chloride
IUPAC Name	2-acetyloxyethyl(trimethyl)azanium;chloride
InChI Key	JUGOREOARAHOCO-UHFFFAOYSA-M
Molecular Formula	C7H16ClNO2

Tetramethylammonium tetrafluoroborate, 97%

CAS: 661-36-9 Molecular Formula: C4H12BF4N Molecular Weight (g/mol): 160.95 MDL Number: MFCD00011745 InChI Key: XWFABLFRYCHILB-UHFFFAOYSA-N Synonym: tetramethylammonium tetrafluoroborate,tetramethylammonium fluoroborate,borate 1-, tetrafluoro-, tetramethylammonium salt,tetramethylazanium tetrafluoroborate,n,n,n-trimethylmethanaminium tetrafluoroborate 1-,tetramethylammonium ion tetrafluoroborate,ammonium, tetramethyl-, tetrafluoroborate 1-,acmc-209ntt,methanaminium, n,n,n-trimethyl-, tetrafluoroborate 1-,tetramethyl ammonium tetrafluoroborate PubChem CID: 12621 IUPAC Name: tetramethylazanium;tetrafluoroborate SMILES: C[N+](C)(C)C.F[B-](F)(F)F

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PubChem CID	12621
CAS	661-36-9
Molecular Weight (g/mol)	160.95
MDL Number	MFCD00011745
SMILES	C[N+](C)(C)C.F[B-](F)(F)F
Synonym	tetramethylammonium tetrafluoroborate,tetramethylammonium fluoroborate,borate 1-, tetrafluoro-, tetramethylammonium salt,tetramethylazanium tetrafluoroborate,n,n,n-trimethylmethanaminium tetrafluoroborate 1-,tetramethylammonium ion tetrafluoroborate,ammonium, tetramethyl-, tetrafluoroborate 1-,acmc-209ntt,methanaminium, n,n,n-trimethyl-, tetrafluoroborate 1-,tetramethyl ammonium tetrafluoroborate
IUPAC Name	tetramethylazanium;tetrafluoroborate
InChI Key	XWFABLFRYCHILB-UHFFFAOYSA-N
Molecular Formula	C4H12BF4N

Tetra-n-octylammonium bromide, 98%

CAS: 14866-33-2 Molecular Formula: C₃₂H₆₈BrN Molecular Weight (g/mol): 546.81 MDL Number: MFCD00011863 InChI Key: QBVXKDJEZKEASM-UHFFFAOYSA-M Synonym: tetraoctylammonium bromide,tetra-n-octylammonium bromide,tetraoctylazanium bromide,tetraoctyl ammonium bromide,1-octanaminium, n,n,n-trioctyl-, bromide,unii-52qw29owoc,52qw29owoc,tetra n-octyl ammonium bromide,acmc-1bvth,tetra-octylammonium bromide PubChem CID: 2734117 IUPAC Name: tetraoctylazanium;bromide SMILES: CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[Br-]

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PubChem CID	2734117
CAS	14866-33-2
Molecular Weight (g/mol)	546.81
MDL Number	MFCD00011863
SMILES	CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[Br-]
Synonym	tetraoctylammonium bromide,tetra-n-octylammonium bromide,tetraoctylazanium bromide,tetraoctyl ammonium bromide,1-octanaminium, n,n,n-trioctyl-, bromide,unii-52qw29owoc,52qw29owoc,tetra n-octyl ammonium bromide,acmc-1bvth,tetra-octylammonium bromide
IUPAC Name	tetraoctylazanium;bromide
InChI Key	QBVXKDJEZKEASM-UHFFFAOYSA-M
Molecular Formula	C₃₂H₆₈BrN

n-Octadecyltrimethylammonium chloride, 95%

CAS: 112-03-8 Molecular Formula: C21H46ClN Molecular Weight (g/mol): 348.06 MDL Number: MFCD00050188 InChI Key: VBIIFPGSPJYLRR-UHFFFAOYSA-M Synonym: n,n,n-trimethyloctadecan-1-aminium chloride,stac,octadecyltrimethylammonium chloride,cation ab,stearyltrimethylammonium chloride,steartrimonium chloride,trimethyloctadecylammonium chloride,1-octadecanaminium, n,n,n-trimethyl-, chloride,nissan cation ab,aliquat 7 PubChem CID: 8155 ChEBI: CHEBI:81710 IUPAC Name: trimethyl(octadecyl)azanium;chloride SMILES: [Cl-].CCCCCCCCCCCCCCCCCC[N+](C)(C)C

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PubChem CID	8155
CAS	112-03-8
Molecular Weight (g/mol)	348.06
ChEBI	CHEBI:81710
MDL Number	MFCD00050188
SMILES	[Cl-].CCCCCCCCCCCCCCCCCC[N+](C)(C)C
Synonym	n,n,n-trimethyloctadecan-1-aminium chloride,stac,octadecyltrimethylammonium chloride,cation ab,stearyltrimethylammonium chloride,steartrimonium chloride,trimethyloctadecylammonium chloride,1-octadecanaminium, n,n,n-trimethyl-, chloride,nissan cation ab,aliquat 7
IUPAC Name	trimethyl(octadecyl)azanium;chloride
InChI Key	VBIIFPGSPJYLRR-UHFFFAOYSA-M
Molecular Formula	C21H46ClN

Dodecyltrimethylammonium Chloride, 50% Soln, MP Biomedicals

CAS: 112-00-5 Molecular Formula: C15H34ClN Molecular Weight (g/mol): 263.894 InChI Key: DDXLVDQZPFLQMZ-UHFFFAOYSA-M Synonym: dodecyltrimethylammonium chloride,alicop,cation bb,aliquat 4,n,n,n-trimethyldodecan-1-aminium chloride,laurtrimonium chloride,dehyquart lt,cation fb,nissan cation bb,lauryltrimethylammonium chloride PubChem CID: 8152 IUPAC Name: dodecyl(trimethyl)azanium;chloride SMILES: CCCCCCCCCCCC[N+](C)(C)C.[Cl-]

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Specifications

PubChem CID	8152
CAS	112-00-5
Molecular Weight (g/mol)	263.894
SMILES	CCCCCCCCCCCC[N+](C)(C)C.[Cl-]
Synonym	dodecyltrimethylammonium chloride,alicop,cation bb,aliquat 4,n,n,n-trimethyldodecan-1-aminium chloride,laurtrimonium chloride,dehyquart lt,cation fb,nissan cation bb,lauryltrimethylammonium chloride
IUPAC Name	dodecyl(trimethyl)azanium;chloride
InChI Key	DDXLVDQZPFLQMZ-UHFFFAOYSA-M
Molecular Formula	C15H34ClN

Quaternary ammonium salts

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