Prenol lipids
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(+/-)-Citronellal, 96%
CAS: 106-23-0 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00038090 InChI Key: NEHNMFOYXAPHSD-SNVBAGLBSA-N Synonym: citronellal,rhodinal,3,7-dimethyl-6-octenal,2,3-dihydrocitral,6-octenal, 3,7-dimethyl,citronellel,citronella,3,7-dimethyl-6-octen-1-al,beta-citronellal,d-rhodinal PubChem CID: 7794 ChEBI: CHEBI:47856 SMILES: C[C@H](CCC=C(C)C)CC=O
| PubChem CID | 7794 |
|---|---|
| CAS | 106-23-0 |
| Molecular Weight (g/mol) | 154.25 |
| ChEBI | CHEBI:47856 |
| MDL Number | MFCD00038090 |
| SMILES | C[C@H](CCC=C(C)C)CC=O |
| Synonym | citronellal,rhodinal,3,7-dimethyl-6-octenal,2,3-dihydrocitral,6-octenal, 3,7-dimethyl,citronellel,citronella,3,7-dimethyl-6-octen-1-al,beta-citronellal,d-rhodinal |
| InChI Key | NEHNMFOYXAPHSD-SNVBAGLBSA-N |
| Molecular Formula | C10H18O |
Thymolphthalein (0.1% in ca. 95% Ethanol) [for pH Determination and Titration], TCI America™
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CAS: 125-20-2 Molecular Formula: C28H30O4 Molecular Weight (g/mol): 430.544 MDL Number: MFCD00005909 InChI Key: LDKDGDIWEUUXSH-UHFFFAOYSA-N Synonym: thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one PubChem CID: 31316 IUPAC Name: 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one SMILES: CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O
| PubChem CID | 31316 |
|---|---|
| CAS | 125-20-2 |
| Molecular Weight (g/mol) | 430.544 |
| MDL Number | MFCD00005909 |
| SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O |
| Synonym | thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one |
| IUPAC Name | 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one |
| InChI Key | LDKDGDIWEUUXSH-UHFFFAOYSA-N |
| Molecular Formula | C28H30O4 |
Linalool, 97%
CAS: 78-70-6 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00008906 InChI Key: CDOSHBSSFJOMGT-UHFFFAOYSA-N Synonym: linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool PubChem CID: 6549 ChEBI: CHEBI:17580 IUPAC Name: 3,7-dimethylocta-1,6-dien-3-ol SMILES: CC(=CCCC(C)(C=C)O)C
| PubChem CID | 6549 |
|---|---|
| CAS | 78-70-6 |
| Molecular Weight (g/mol) | 154.253 |
| ChEBI | CHEBI:17580 |
| MDL Number | MFCD00008906 |
| SMILES | CC(=CCCC(C)(C=C)O)C |
| Synonym | linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool |
| IUPAC Name | 3,7-dimethylocta-1,6-dien-3-ol |
| InChI Key | CDOSHBSSFJOMGT-UHFFFAOYSA-N |
| Molecular Formula | C10H18O |
(1R)-(+)-alpha-Pinene 97.0+%, TCI America™
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CAS: 7785-70-8 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00001346 InChI Key: GRWFGVWFFZKLTI-RKDXNWHRSA-N Synonym: +-alpha-pinene,1r,5r-2,6,6-trimethylbicyclo 3.1.1 hept-2-ene,1r-+-alpha-pinene,1r,5r-alpha-pinene,unii-h6cm4twh1w,+-pinene,h6cm4twh1w,1r,5r-2-pinene,bicyclo 3.1.1 hept-2-ene, 2,6,6-trimethyl-, 1r,5r,+-pin-2 3-ene PubChem CID: 82227 ChEBI: CHEBI:28261 IUPAC Name: (1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene SMILES: CC1=CC[C@@H]2C[C@H]1C2(C)C
| PubChem CID | 82227 |
|---|---|
| CAS | 7785-70-8 |
| Molecular Weight (g/mol) | 136.24 |
| ChEBI | CHEBI:28261 |
| MDL Number | MFCD00001346 |
| SMILES | CC1=CC[C@@H]2C[C@H]1C2(C)C |
| Synonym | +-alpha-pinene,1r,5r-2,6,6-trimethylbicyclo 3.1.1 hept-2-ene,1r-+-alpha-pinene,1r,5r-alpha-pinene,unii-h6cm4twh1w,+-pinene,h6cm4twh1w,1r,5r-2-pinene,bicyclo 3.1.1 hept-2-ene, 2,6,6-trimethyl-, 1r,5r,+-pin-2 3-ene |
| IUPAC Name | (1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene |
| InChI Key | GRWFGVWFFZKLTI-RKDXNWHRSA-N |
| Molecular Formula | C10H16 |
(+)-Diisopinocampheylchloroborane, 1.8M solution in hexanes, AcroSeal™, Thermo Scientific Chemicals
CAS: 112246-73-8 Molecular Formula: C20H34BCl Molecular Weight (g/mol): 320.75 MDL Number: MFCD00074808 InChI Key: PSEHHVRCDVOTID-NAVXHOJHSA-N Synonym: +-b-chlorodiisopinocamphenylborane PubChem CID: 133124869 IUPAC Name: chloro-bis[(3R,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]borane SMILES: C[C@H]1[C@@H]2C[C@H](C[C@@H]1B(Cl)[C@H]1C[C@H]3C[C@@H]([C@@H]1C)C3(C)C)C2(C)C
| PubChem CID | 133124869 |
|---|---|
| CAS | 112246-73-8 |
| Molecular Weight (g/mol) | 320.75 |
| MDL Number | MFCD00074808 |
| SMILES | C[C@H]1[C@@H]2C[C@H](C[C@@H]1B(Cl)[C@H]1C[C@H]3C[C@@H]([C@@H]1C)C3(C)C)C2(C)C |
| Synonym | +-b-chlorodiisopinocamphenylborane |
| IUPAC Name | chloro-bis[(3R,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]borane |
| InChI Key | PSEHHVRCDVOTID-NAVXHOJHSA-N |
| Molecular Formula | C20H34BCl |
4-Isopropylphenylacetonitrile, 98+%
CAS: 4395-87-3 Molecular Formula: C11H13N Molecular Weight (g/mol): 159.23 MDL Number: MFCD00040892 InChI Key: RIPHZOPMCRSGSI-UHFFFAOYSA-N Synonym: 4-isopropylphenylacetonitrile,2-4-isopropylphenyl acetonitrile,4-isopropylphenyl acetonitrile,2-4-propan-2-yl phenyl acetonitrile,4-propan-2-yl phenyl acetonitrile,pubchem17248,acmc-20ai20,2-4-propan-2-ylphenyl acetonitrile,2-4-methylethyl phenyl ethanenitrile PubChem CID: 138222 IUPAC Name: 2-(4-propan-2-ylphenyl)acetonitrile SMILES: CC(C)C1=CC=C(CC#N)C=C1
| PubChem CID | 138222 |
|---|---|
| CAS | 4395-87-3 |
| Molecular Weight (g/mol) | 159.23 |
| MDL Number | MFCD00040892 |
| SMILES | CC(C)C1=CC=C(CC#N)C=C1 |
| Synonym | 4-isopropylphenylacetonitrile,2-4-isopropylphenyl acetonitrile,4-isopropylphenyl acetonitrile,2-4-propan-2-yl phenyl acetonitrile,4-propan-2-yl phenyl acetonitrile,pubchem17248,acmc-20ai20,2-4-propan-2-ylphenyl acetonitrile,2-4-methylethyl phenyl ethanenitrile |
| IUPAC Name | 2-(4-propan-2-ylphenyl)acetonitrile |
| InChI Key | RIPHZOPMCRSGSI-UHFFFAOYSA-N |
| Molecular Formula | C11H13N |
2,6-Di-tert-butyl-p-benzoquinone, 98+%
CAS: 719-22-2 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.312 MDL Number: MFCD00001601 InChI Key: RDQSIADLBQFVMY-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-p-benzoquinone,2,6-di-tert-butyl-1,4-benzoquinone,2,6-di-tert-butylcyclohexa-2,5-diene-1,4-dione,2,6-di-tert-butylbenzoquinone,2,6-di-tert-butylquinone,2,6-di-t-butyl-p-benzoquinone,2,5-cyclohexadiene-1,4-dione, 2,6-bis 1,1-dimethylethyl,p-benzoquinone, 2,6-di-tert-butyl,unii-4c9d8l0y0t,2,6-di tert-butyl benzo-1,4-quinone PubChem CID: 12867 IUPAC Name: 2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione SMILES: CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C
| PubChem CID | 12867 |
|---|---|
| CAS | 719-22-2 |
| Molecular Weight (g/mol) | 220.312 |
| MDL Number | MFCD00001601 |
| SMILES | CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C |
| Synonym | 2,6-di-tert-butyl-p-benzoquinone,2,6-di-tert-butyl-1,4-benzoquinone,2,6-di-tert-butylcyclohexa-2,5-diene-1,4-dione,2,6-di-tert-butylbenzoquinone,2,6-di-tert-butylquinone,2,6-di-t-butyl-p-benzoquinone,2,5-cyclohexadiene-1,4-dione, 2,6-bis 1,1-dimethylethyl,p-benzoquinone, 2,6-di-tert-butyl,unii-4c9d8l0y0t,2,6-di tert-butyl benzo-1,4-quinone |
| IUPAC Name | 2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione |
| InChI Key | RDQSIADLBQFVMY-UHFFFAOYSA-N |
| Molecular Formula | C14H20O2 |
Geranyl linalool, ca. 95%, Tech., mixture of isomers
CAS: 1113-21-9 Molecular Formula: C20H34O Molecular Weight (g/mol): 290.49 MDL Number: MFCD00059363 InChI Key: IQDXAJNQKSIPGB-HQSZAHFGNA-N Synonym: geranyl linalool,geranyllinalool,3,7,11,15-tetramethyl-1,6,10,14-hexadecatetraen-3-ol,e,e-geranyllinalool,6e,10e-geranyllinalool,3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol,6e,10e-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol,e,e-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol,1,6,10,14-hexadecatetraen-3-ol, 3,7,11,15-tetramethyl-, 6e,10e,1,6,10,14-hexadecatetraen-3-ol, 3,7,11,15-tetramethyl PubChem CID: 5365872 ChEBI: CHEBI:74299 IUPAC Name: (6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol SMILES: CC(C)=CCC\C(C)=C\CC\C(C)=C\CCC(C)(O)C=C
| PubChem CID | 5365872 |
|---|---|
| CAS | 1113-21-9 |
| Molecular Weight (g/mol) | 290.49 |
| ChEBI | CHEBI:74299 |
| MDL Number | MFCD00059363 |
| SMILES | CC(C)=CCC\C(C)=C\CC\C(C)=C\CCC(C)(O)C=C |
| Synonym | geranyl linalool,geranyllinalool,3,7,11,15-tetramethyl-1,6,10,14-hexadecatetraen-3-ol,e,e-geranyllinalool,6e,10e-geranyllinalool,3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol,6e,10e-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol,e,e-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol,1,6,10,14-hexadecatetraen-3-ol, 3,7,11,15-tetramethyl-, 6e,10e,1,6,10,14-hexadecatetraen-3-ol, 3,7,11,15-tetramethyl |
| IUPAC Name | (6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-ol |
| InChI Key | IQDXAJNQKSIPGB-HQSZAHFGNA-N |
| Molecular Formula | C20H34O |
Squalane, ≥99.0% (GC), Honeywell™ Fluka™
CAS: 111-01-3 Molecular Formula: C30H62 Molecular Weight (g/mol): 422.826 MDL Number: MFCD00008953 InChI Key: PRAKJMSDJKAYCZ-UHFFFAOYSA-N Synonym: squalane,perhydrosqualene,dodecahydrosqualene,cosbiol,vitabiosol,spinacane,robane,hexamethyltetracosane,tetracosane, 2,6,10,15,19,23-hexamethyl,hexamethyl tetracosane PubChem CID: 8089 IUPAC Name: 2,6,10,15,19,23-hexamethyltetracosane SMILES: CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C
| PubChem CID | 8089 |
|---|---|
| CAS | 111-01-3 |
| Molecular Weight (g/mol) | 422.826 |
| MDL Number | MFCD00008953 |
| SMILES | CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C |
| Synonym | squalane,perhydrosqualene,dodecahydrosqualene,cosbiol,vitabiosol,spinacane,robane,hexamethyltetracosane,tetracosane, 2,6,10,15,19,23-hexamethyl,hexamethyl tetracosane |
| IUPAC Name | 2,6,10,15,19,23-hexamethyltetracosane |
| InChI Key | PRAKJMSDJKAYCZ-UHFFFAOYSA-N |
| Molecular Formula | C30H62 |
2-Bromobornane, technical
CAS: 4443-48-5 Molecular Formula: C10H17Br Molecular Weight (g/mol): 217.15 InChI Key: OTOQMOVZIUGCQE-UHFFFAOYSA-N Synonym: bornyl bromide,2-bromobornane,bornyl bromide, pract.,2-bromo-1,7,7-trimethylbicyclo 2.2.1 heptane,bornylbromid,bornylbromide,bornane, 2-bromo,3-bromo-4,7,7-trimethylbicyclo 2.2.1 heptane,2-bromo-1,7,7-trimethylbicyclo 2.2.1 heptane # PubChem CID: 138249 IUPAC Name: 3-bromo-4,7,7-trimethylbicyclo[2.2.1]heptane SMILES: CC1(C2CCC1(C(C2)Br)C)C
| PubChem CID | 138249 |
|---|---|
| CAS | 4443-48-5 |
| Molecular Weight (g/mol) | 217.15 |
| SMILES | CC1(C2CCC1(C(C2)Br)C)C |
| Synonym | bornyl bromide,2-bromobornane,bornyl bromide, pract.,2-bromo-1,7,7-trimethylbicyclo 2.2.1 heptane,bornylbromid,bornylbromide,bornane, 2-bromo,3-bromo-4,7,7-trimethylbicyclo 2.2.1 heptane,2-bromo-1,7,7-trimethylbicyclo 2.2.1 heptane # |
| IUPAC Name | 3-bromo-4,7,7-trimethylbicyclo[2.2.1]heptane |
| InChI Key | OTOQMOVZIUGCQE-UHFFFAOYSA-N |
| Molecular Formula | C10H17Br |
Flurbiprofen, USP, 99-100.5%, Spectrum™ Chemical
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CAS: 5104-49-4 Molecular Formula: C15H13FO2 Molecular Weight (g/mol): 244.27 MDL Number: MFCD00079303 InChI Key: SYTBZMRGLBWNTM-UHFFFAOYNA-N IUPAC Name: 2-{2-fluoro-[1,1'-biphenyl]-4-yl}propanoic acid SMILES: CC(C(O)=O)C1=CC=C(C(F)=C1)C1=CC=CC=C1
| CAS | 5104-49-4 |
|---|---|
| Molecular Weight (g/mol) | 244.27 |
| MDL Number | MFCD00079303 |
| SMILES | CC(C(O)=O)C1=CC=C(C(F)=C1)C1=CC=CC=C1 |
| IUPAC Name | 2-{2-fluoro-[1,1'-biphenyl]-4-yl}propanoic acid |
| InChI Key | SYTBZMRGLBWNTM-UHFFFAOYNA-N |
| Molecular Formula | C15H13FO2 |
Menthol, Crystal, FCC, Spectrum™ Chemical
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CAS: 2216-51-5 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.27 InChI Key: NOOLISFMXDJSKH-KXUCPTDWSA-N IUPAC Name: (1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol SMILES: CC(C)[C@@H]1CC[C@@H](C)C[C@H]1O
| CAS | 2216-51-5 |
|---|---|
| Molecular Weight (g/mol) | 156.27 |
| SMILES | CC(C)[C@@H]1CC[C@@H](C)C[C@H]1O |
| IUPAC Name | (1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol |
| InChI Key | NOOLISFMXDJSKH-KXUCPTDWSA-N |
| Molecular Formula | C10H20O |
4-Isopropylbenzyl chloride, 95%
CAS: 2051-18-5 Molecular Formula: C10H13Cl Molecular Weight (g/mol): 168.664 MDL Number: MFCD00018885 InChI Key: CYAKWEQUWJAHLW-UHFFFAOYSA-N Synonym: 4-isopropylbenzyl chloride,1-chloromethyl-4-isopropylbenzene,p-cymene, 7-chloro,p-isopropylbenzyl chloride,7-chloro-p-cymene,4-isopropylbenzylchloride,benzene, 1-chloromethyl-4-1-methylethyl,1-chloromethyl-4-propan-2-yl benzene,p-isopropyl benzyl chloride,benzene, 1-chloromethyl-4-methylethyl PubChem CID: 74916 IUPAC Name: 1-(chloromethyl)-4-propan-2-ylbenzene SMILES: CC(C)C1=CC=C(C=C1)CCl
| PubChem CID | 74916 |
|---|---|
| CAS | 2051-18-5 |
| Molecular Weight (g/mol) | 168.664 |
| MDL Number | MFCD00018885 |
| SMILES | CC(C)C1=CC=C(C=C1)CCl |
| Synonym | 4-isopropylbenzyl chloride,1-chloromethyl-4-isopropylbenzene,p-cymene, 7-chloro,p-isopropylbenzyl chloride,7-chloro-p-cymene,4-isopropylbenzylchloride,benzene, 1-chloromethyl-4-1-methylethyl,1-chloromethyl-4-propan-2-yl benzene,p-isopropyl benzyl chloride,benzene, 1-chloromethyl-4-methylethyl |
| IUPAC Name | 1-(chloromethyl)-4-propan-2-ylbenzene |
| InChI Key | CYAKWEQUWJAHLW-UHFFFAOYSA-N |
| Molecular Formula | C10H13Cl |
Terpin Hydrate, USP, 98-100.5%, Spectrum™ Chemical
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CAS: 2451-01-6 Molecular Formula: C10H22O3 Molecular Weight (g/mol): 190.28 InChI Key: JGKJMBOJWVAMIJ-UHFFFAOYSA-N IUPAC Name: 4-(2-hydroxypropan-2-yl)-1-methylcyclohexan-1-ol hydrate SMILES: O.CC(C)(O)C1CCC(C)(O)CC1
| CAS | 2451-01-6 |
|---|---|
| Molecular Weight (g/mol) | 190.28 |
| SMILES | O.CC(C)(O)C1CCC(C)(O)CC1 |
| IUPAC Name | 4-(2-hydroxypropan-2-yl)-1-methylcyclohexan-1-ol hydrate |
| InChI Key | JGKJMBOJWVAMIJ-UHFFFAOYSA-N |
| Molecular Formula | C10H22O3 |
Nerol, 97%
CAS: 106-25-2 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00063204 InChI Key: GLZPCOQZEFWAFX-YFHOEESVSA-N Synonym: nerol,cis-geraniol,neryl alcohol,z-3,7-dimethylocta-2,6-dien-1-ol,z-geraniol,2z-3,7-dimethylocta-2,6-dien-1-ol,2,6-octadien-1-ol, 3,7-dimethyl-, 2z,nerol natural,cis-3,7-dimethyl-2,6-octadien-1-ol,z-3,7-dimethyl-2,6-octadien-1-ol PubChem CID: 643820 ChEBI: CHEBI:29452 IUPAC Name: (2Z)-3,7-dimethylocta-2,6-dien-1-ol SMILES: CC(C)=CCC\C(C)=C/CO
| PubChem CID | 643820 |
|---|---|
| CAS | 106-25-2 |
| Molecular Weight (g/mol) | 154.25 |
| ChEBI | CHEBI:29452 |
| MDL Number | MFCD00063204 |
| SMILES | CC(C)=CCC\C(C)=C/CO |
| Synonym | nerol,cis-geraniol,neryl alcohol,z-3,7-dimethylocta-2,6-dien-1-ol,z-geraniol,2z-3,7-dimethylocta-2,6-dien-1-ol,2,6-octadien-1-ol, 3,7-dimethyl-, 2z,nerol natural,cis-3,7-dimethyl-2,6-octadien-1-ol,z-3,7-dimethyl-2,6-octadien-1-ol |
| IUPAC Name | (2Z)-3,7-dimethylocta-2,6-dien-1-ol |
| InChI Key | GLZPCOQZEFWAFX-YFHOEESVSA-N |
| Molecular Formula | C10H18O |