
Organooxygen compounds
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Isovalerophenone 99.0+%, TCI America™
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CAS: 582-62-7 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00026486 InChI Key: HEOVGVNITGAUKL-UHFFFAOYSA-N Synonym: Isobutyl Phenyl Ketone PubChem CID: 68493 IUPAC Name: 3-methyl-1-phenylbutan-1-one SMILES: CC(C)CC(=O)C1=CC=CC=C1
PubChem CID | 68493 |
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CAS | 582-62-7 |
Molecular Weight (g/mol) | 162.23 |
MDL Number | MFCD00026486 |
SMILES | CC(C)CC(=O)C1=CC=CC=C1 |
Synonym | Isobutyl Phenyl Ketone |
IUPAC Name | 3-methyl-1-phenylbutan-1-one |
InChI Key | HEOVGVNITGAUKL-UHFFFAOYSA-N |
Molecular Formula | C11H14O |
(-)-2,3-O-Isopropylidene-D-threitol 98.0+%, TCI America™
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CAS: 73346-74-4 Molecular Formula: C7H14O4 Molecular Weight (g/mol): 162.185 MDL Number: MFCD00009761 InChI Key: INVRLGIKFANLFP-PHDIDXHHSA-N Synonym: --2,3-o-isopropylidene-d-threitol,2,3-o-isopropylidene-d-threitol,4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl dimethanol,2-3-o-isopropylidene-d-threitol,4r,5r---2,2-dimethyl-1,3-dioxolane-4,5-dimethanol,trans-4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl dimethanol,4r,5r-5-hydroxymethyl-2,2-dimethyl-1,3-dioxolan-4-yl methanol,4r,5r-4,5-bis hydroxymethyl-2,2-dimethyl-1,3-dioxolane,pubchem6768 PubChem CID: 785244 IUPAC Name: [(4R,5R)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol SMILES: CC1(OC(C(O1)CO)CO)C
PubChem CID | 785244 |
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CAS | 73346-74-4 |
Molecular Weight (g/mol) | 162.185 |
MDL Number | MFCD00009761 |
SMILES | CC1(OC(C(O1)CO)CO)C |
Synonym | --2,3-o-isopropylidene-d-threitol,2,3-o-isopropylidene-d-threitol,4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl dimethanol,2-3-o-isopropylidene-d-threitol,4r,5r---2,2-dimethyl-1,3-dioxolane-4,5-dimethanol,trans-4r,5r-2,2-dimethyl-1,3-dioxolane-4,5-diyl dimethanol,4r,5r-5-hydroxymethyl-2,2-dimethyl-1,3-dioxolan-4-yl methanol,4r,5r-4,5-bis hydroxymethyl-2,2-dimethyl-1,3-dioxolane,pubchem6768 |
IUPAC Name | [(4R,5R)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol |
InChI Key | INVRLGIKFANLFP-PHDIDXHHSA-N |
Molecular Formula | C7H14O4 |
Isochroman 98.0+%, TCI America™
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CAS: 493-05-0 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00006913 InChI Key: HEBMCVBCEDMUOF-UHFFFAOYSA-N Synonym: isochroman,isochromane,3,4-dihydro-1h-2-benzopyran,1h-2-benzopyran, 3,4-dihydro,3,4-dihydro-1h-benzo c pyran,pubchem20553,acmc-209kfu,isochroman 10g,ksc237m1l PubChem CID: 96266 ChEBI: CHEBI:33225 IUPAC Name: 3,4-dihydro-1H-2-benzopyran SMILES: C1CC2=CC=CC=C2CO1
PubChem CID | 96266 |
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CAS | 493-05-0 |
Molecular Weight (g/mol) | 134.18 |
ChEBI | CHEBI:33225 |
MDL Number | MFCD00006913 |
SMILES | C1CC2=CC=CC=C2CO1 |
Synonym | isochroman,isochromane,3,4-dihydro-1h-2-benzopyran,1h-2-benzopyran, 3,4-dihydro,3,4-dihydro-1h-benzo c pyran,pubchem20553,acmc-209kfu,isochroman 10g,ksc237m1l |
IUPAC Name | 3,4-dihydro-1H-2-benzopyran |
InChI Key | HEBMCVBCEDMUOF-UHFFFAOYSA-N |
Molecular Formula | C9H10O |
4'-Isopropylacetophenone 95.0+%, TCI America™
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CAS: 645-13-6 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00048297 InChI Key: PDLCCNYKIIUWHA-UHFFFAOYSA-N Synonym: 4'-isopropylacetophenone,4-isopropylacetophenone,p-isopropylacetophenone,cuminone,1-4-isopropylphenyl ethanone,ethanone, 1-4-1-methylethyl phenyl,acetophenone, 4'-isopropyl,unii-742zkz2a6d,methyl p-isopropylphenyl ketone,1-4-propan-2-yl phenyl ethan-1-one PubChem CID: 12578 IUPAC Name: 1-[4-(propan-2-yl)phenyl]ethan-1-one SMILES: CC(C)C1=CC=C(C=C1)C(C)=O
PubChem CID | 12578 |
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CAS | 645-13-6 |
Molecular Weight (g/mol) | 162.23 |
MDL Number | MFCD00048297 |
SMILES | CC(C)C1=CC=C(C=C1)C(C)=O |
Synonym | 4'-isopropylacetophenone,4-isopropylacetophenone,p-isopropylacetophenone,cuminone,1-4-isopropylphenyl ethanone,ethanone, 1-4-1-methylethyl phenyl,acetophenone, 4'-isopropyl,unii-742zkz2a6d,methyl p-isopropylphenyl ketone,1-4-propan-2-yl phenyl ethan-1-one |
IUPAC Name | 1-[4-(propan-2-yl)phenyl]ethan-1-one |
InChI Key | PDLCCNYKIIUWHA-UHFFFAOYSA-N |
Molecular Formula | C11H14O |
5-Iodoisatin 98.0+%, TCI America™
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CAS: 20780-76-1 Molecular Formula: C8H4INO2 Molecular Weight (g/mol): 273.029 InChI Key: OEUGDMOJQQLVAZ-UHFFFAOYSA-N Synonym: 5-iodoisatin,5-iodoindoline-2,3-dione,5-iodo isatin,5-iodoindole-2,3-dione,5-iodo-2,3-dioxoindoline,1h-indole-2,3-dione, 5-iodo,5-iodo-2,3-dihydro-1h-indole-2,3-dione,5-iodo-1h-benzo d azolidine-2,3-dione,5-iodo-isatine,5-iodo-isatin PubChem CID: 88695 IUPAC Name: 5-iodo-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1I)C(=O)C(=O)N2
PubChem CID | 88695 |
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CAS | 20780-76-1 |
Molecular Weight (g/mol) | 273.029 |
SMILES | C1=CC2=C(C=C1I)C(=O)C(=O)N2 |
Synonym | 5-iodoisatin,5-iodoindoline-2,3-dione,5-iodo isatin,5-iodoindole-2,3-dione,5-iodo-2,3-dioxoindoline,1h-indole-2,3-dione, 5-iodo,5-iodo-2,3-dihydro-1h-indole-2,3-dione,5-iodo-1h-benzo d azolidine-2,3-dione,5-iodo-isatine,5-iodo-isatin |
IUPAC Name | 5-iodo-1H-indole-2,3-dione |
InChI Key | OEUGDMOJQQLVAZ-UHFFFAOYSA-N |
Molecular Formula | C8H4INO2 |
Indole-5-carboxaldehyde 98.0+%, TCI America™
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CAS: 1196-69-6 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.161 MDL Number: MFCD02093664 InChI Key: ADZUEEUKBYCSEY-UHFFFAOYSA-N Synonym: indole-5-carboxaldehyde,5-formylindole,indole-5-carbaldehyde,1h-indole-5-carboxaldehyde,5-indolealdehyde,indole-5-aldehyde,5-formyl-1h-indole,5-indolecarboxaldehyde,indole-5-carboxaldehyde 5-formylindole,5-formyl-indole PubChem CID: 589040 IUPAC Name: 1H-indole-5-carbaldehyde SMILES: C1=CC2=C(C=CN2)C=C1C=O
PubChem CID | 589040 |
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CAS | 1196-69-6 |
Molecular Weight (g/mol) | 145.161 |
MDL Number | MFCD02093664 |
SMILES | C1=CC2=C(C=CN2)C=C1C=O |
Synonym | indole-5-carboxaldehyde,5-formylindole,indole-5-carbaldehyde,1h-indole-5-carboxaldehyde,5-indolealdehyde,indole-5-aldehyde,5-formyl-1h-indole,5-indolecarboxaldehyde,indole-5-carboxaldehyde 5-formylindole,5-formyl-indole |
IUPAC Name | 1H-indole-5-carbaldehyde |
InChI Key | ADZUEEUKBYCSEY-UHFFFAOYSA-N |
Molecular Formula | C9H7NO |
5-Iodo-2-furaldehyde 98.0+%, TCI America™
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CAS: 2689-65-8 Molecular Formula: C5H3IO2 Molecular Weight (g/mol): 221.981 MDL Number: MFCD00159503 InChI Key: QPGPCPKDVSPJAY-UHFFFAOYSA-N Synonym: 5-iodo-2-furaldehyde,5-iodofurfural,5-iodo-2-furancarboxaldehyde,5-iodo-2-furaldehdye,2-furancarboxaldehyde, 5-iodo,5-iodofuraldehyde,acmc-209gtv,5-iodofurancarboxaldehyde,5-iodanylfuran-2-carbaldehyde PubChem CID: 693264 IUPAC Name: 5-iodofuran-2-carbaldehyde SMILES: C1=C(OC(=C1)I)C=O
PubChem CID | 693264 |
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CAS | 2689-65-8 |
Molecular Weight (g/mol) | 221.981 |
MDL Number | MFCD00159503 |
SMILES | C1=C(OC(=C1)I)C=O |
Synonym | 5-iodo-2-furaldehyde,5-iodofurfural,5-iodo-2-furancarboxaldehyde,5-iodo-2-furaldehdye,2-furancarboxaldehyde, 5-iodo,5-iodofuraldehyde,acmc-209gtv,5-iodofurancarboxaldehyde,5-iodanylfuran-2-carbaldehyde |
IUPAC Name | 5-iodofuran-2-carbaldehyde |
InChI Key | QPGPCPKDVSPJAY-UHFFFAOYSA-N |
Molecular Formula | C5H3IO2 |
Isophthalaldehydic Acid 98.0+%, TCI America™
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CAS: 619-21-6 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.133 MDL Number: MFCD00039575 InChI Key: UHDNUPHSDMOGCR-UHFFFAOYSA-N Synonym: 3-carboxybenzaldehyde,benzoic acid, 3-formyl,m-formyl benzoic acid,3-formyl benzoic acid,3-formyl-benzoic acid,unii-hb95grm95d,m-carboxybenzaldehyde,hb95grm95d,3-formylbenzoicacid,isophthalaldehydsaure PubChem CID: 12077 IUPAC Name: 3-formylbenzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C=O
PubChem CID | 12077 |
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CAS | 619-21-6 |
Molecular Weight (g/mol) | 150.133 |
MDL Number | MFCD00039575 |
SMILES | C1=CC(=CC(=C1)C(=O)O)C=O |
Synonym | 3-carboxybenzaldehyde,benzoic acid, 3-formyl,m-formyl benzoic acid,3-formyl benzoic acid,3-formyl-benzoic acid,unii-hb95grm95d,m-carboxybenzaldehyde,hb95grm95d,3-formylbenzoicacid,isophthalaldehydsaure |
IUPAC Name | 3-formylbenzoic acid |
InChI Key | UHDNUPHSDMOGCR-UHFFFAOYSA-N |
Molecular Formula | C8H6O3 |
DL-Glyceraldehyde Diethyl Acetal 95.0+%, TCI America™
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CAS: 10487-05-5 Molecular Formula: C7H16O4 Molecular Weight (g/mol): 164.201 MDL Number: MFCD00059599 InChI Key: BPNZBKXZVJVEJD-UHFFFAOYSA-N PubChem CID: 542749 IUPAC Name: 3,3-diethoxypropane-1,2-diol SMILES: CCOC(C(CO)O)OCC
PubChem CID | 542749 |
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CAS | 10487-05-5 |
Molecular Weight (g/mol) | 164.201 |
MDL Number | MFCD00059599 |
SMILES | CCOC(C(CO)O)OCC |
IUPAC Name | 3,3-diethoxypropane-1,2-diol |
InChI Key | BPNZBKXZVJVEJD-UHFFFAOYSA-N |
Molecular Formula | C7H16O4 |
1,3-Indandione 97.0+%, TCI America™
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CAS: 606-23-5 Molecular Formula: C9H6O2 Molecular Weight (g/mol): 146.145 MDL Number: MFCD00003779 InChI Key: UHKAJLSKXBADFT-UHFFFAOYSA-N Synonym: 1,3-indanedione,1,3-indandione,1h-indene-1,3 2h-dione,1,3-diketohydrindene,indan-1,3-dione,1,3-indanone,indane-1,3-dione,diketohydrindene,1,3-indandion,unii-4djn7yg35g PubChem CID: 11815 ChEBI: CHEBI:78877 IUPAC Name: indene-1,3-dione SMILES: C1C(=O)C2=CC=CC=C2C1=O
PubChem CID | 11815 |
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CAS | 606-23-5 |
Molecular Weight (g/mol) | 146.145 |
ChEBI | CHEBI:78877 |
MDL Number | MFCD00003779 |
SMILES | C1C(=O)C2=CC=CC=C2C1=O |
Synonym | 1,3-indanedione,1,3-indandione,1h-indene-1,3 2h-dione,1,3-diketohydrindene,indan-1,3-dione,1,3-indanone,indane-1,3-dione,diketohydrindene,1,3-indandion,unii-4djn7yg35g |
IUPAC Name | indene-1,3-dione |
InChI Key | UHKAJLSKXBADFT-UHFFFAOYSA-N |
Molecular Formula | C9H6O2 |
3-Hydroxy-1-adamantanecarboxylic Acid 97.0+%, TCI America™
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CAS: 42711-75-1 Molecular Formula: C11H15O3 Molecular Weight (g/mol): 195.24 MDL Number: MFCD00193929 InChI Key: CJJMAWPEZKYJAP-JZVMUCMXSA-M Synonym: 3-hydroxy-1-adamantanecarboxylic acid,3-hydroxy-adamantane-1-carboxylic acid,3-hydroxyadamantanecarboxylic acid,1-carboxy-3-adamantanol,3-hydroxy-1-adamantane carboxylic acid,3-hydroxytricyclo 3.3.1.1∼3,7∼ decane-1-carboxylic acid,3-carboxy-1-hydroxyadamantane,3-hydroxy-tricyclo,acmc-1aqmu,3-carboxy-1-adamantanol PubChem CID: 2736518 IUPAC Name: (5R,7S)-3-hydroxyadamantane-1-carboxylate SMILES: OC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C([O-])=O
PubChem CID | 2736518 |
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CAS | 42711-75-1 |
Molecular Weight (g/mol) | 195.24 |
MDL Number | MFCD00193929 |
SMILES | OC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C([O-])=O |
Synonym | 3-hydroxy-1-adamantanecarboxylic acid,3-hydroxy-adamantane-1-carboxylic acid,3-hydroxyadamantanecarboxylic acid,1-carboxy-3-adamantanol,3-hydroxy-1-adamantane carboxylic acid,3-hydroxytricyclo 3.3.1.1∼3,7∼ decane-1-carboxylic acid,3-carboxy-1-hydroxyadamantane,3-hydroxy-tricyclo,acmc-1aqmu,3-carboxy-1-adamantanol |
IUPAC Name | (5R,7S)-3-hydroxyadamantane-1-carboxylate |
InChI Key | CJJMAWPEZKYJAP-JZVMUCMXSA-M |
Molecular Formula | C11H15O3 |
4-(2-Hydroxyethyl)cyclohexanol (cis- and trans- mixture) 98.0+%, TCI America™
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CAS: 74058-21-2 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 InChI Key: SZIBVWWQOOVXHS-UHFFFAOYSA-N Synonym: 2-(4-Hydroxycyclohexyl)ethanol, 4-Hydroxycyclohexaneethanol PubChem CID: 13751153 IUPAC Name: 4-(2-hydroxyethyl)cyclohexan-1-ol SMILES: C1CC(CCC1CCO)O
PubChem CID | 13751153 |
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CAS | 74058-21-2 |
Molecular Weight (g/mol) | 144.214 |
SMILES | C1CC(CCC1CCO)O |
Synonym | 2-(4-Hydroxycyclohexyl)ethanol, 4-Hydroxycyclohexaneethanol |
IUPAC Name | 4-(2-hydroxyethyl)cyclohexan-1-ol |
InChI Key | SZIBVWWQOOVXHS-UHFFFAOYSA-N |
Molecular Formula | C8H16O2 |
2-[(S)-1-Hydroxyethyl]pyridine 97.0+%, TCI America™
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CAS: 59042-90-9 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD06795465 InChI Key: PPHIIIRFJKDTLG-UHFFFAOYNA-N Synonym: s-1-pyridin-2-yl ethanol,s-1-2-pyridyl ethanol,2-s-1-hydroxyethyl pyridine,s---2-1-hydroxyethyl pyridine,s-2-1-hydroxyethyl pyridine,1s-1-pyridin-2-yl ethan-1-ol,1s-1-pyridin-2-yl ethanol,s-1-2-pyridyl ethanol, s-2-1-hydroxyethyl pyridine,pubchem5701,1s-1-pyridin-2-ylethanol PubChem CID: 11094597 IUPAC Name: 1-(pyridin-2-yl)ethan-1-ol SMILES: CC(O)C1=CC=CC=N1
PubChem CID | 11094597 |
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CAS | 59042-90-9 |
Molecular Weight (g/mol) | 123.16 |
MDL Number | MFCD06795465 |
SMILES | CC(O)C1=CC=CC=N1 |
Synonym | s-1-pyridin-2-yl ethanol,s-1-2-pyridyl ethanol,2-s-1-hydroxyethyl pyridine,s---2-1-hydroxyethyl pyridine,s-2-1-hydroxyethyl pyridine,1s-1-pyridin-2-yl ethan-1-ol,1s-1-pyridin-2-yl ethanol,s-1-2-pyridyl ethanol, s-2-1-hydroxyethyl pyridine,pubchem5701,1s-1-pyridin-2-ylethanol |
IUPAC Name | 1-(pyridin-2-yl)ethan-1-ol |
InChI Key | PPHIIIRFJKDTLG-UHFFFAOYNA-N |
Molecular Formula | C7H9NO |
(+/-)-cis-6-Hydroxy-1-methylbicyclo[4.3.0]nonane-2,7-dione 98.0+%, TCI America™
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CAS: 1192178-33-8 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.219 InChI Key: CAYWOGVLFCOLCK-VHSXEESVSA-N Synonym: (+/-)-cis-Hexahydro-7a-hydroxy-3a-methyl-1H-indene-1,4(2H)-dione PubChem CID: 50996020 IUPAC Name: (3aR,7aS)-7a-hydroxy-3a-methyl-3,5,6,7-tetrahydro-2H-indene-1,4-dione SMILES: CC12CCC(=O)C1(CCCC2=O)O
PubChem CID | 50996020 |
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CAS | 1192178-33-8 |
Molecular Weight (g/mol) | 182.219 |
SMILES | CC12CCC(=O)C1(CCCC2=O)O |
Synonym | (+/-)-cis-Hexahydro-7a-hydroxy-3a-methyl-1H-indene-1,4(2H)-dione |
IUPAC Name | (3aR,7aS)-7a-hydroxy-3a-methyl-3,5,6,7-tetrahydro-2H-indene-1,4-dione |
InChI Key | CAYWOGVLFCOLCK-VHSXEESVSA-N |
Molecular Formula | C10H14O3 |
4-Hydroxy-2,6-dimethoxybenzaldehyde 97.0+%, TCI America™
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CAS: 22080-96-2 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD01407645 InChI Key: HZWPJAZIRZFCGX-UHFFFAOYSA-N PubChem CID: 529894 IUPAC Name: 4-hydroxy-2,6-dimethoxybenzaldehyde SMILES: COC1=CC(O)=CC(OC)=C1C=O
PubChem CID | 529894 |
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CAS | 22080-96-2 |
Molecular Weight (g/mol) | 182.18 |
MDL Number | MFCD01407645 |
SMILES | COC1=CC(O)=CC(OC)=C1C=O |
IUPAC Name | 4-hydroxy-2,6-dimethoxybenzaldehyde |
InChI Key | HZWPJAZIRZFCGX-UHFFFAOYSA-N |
Molecular Formula | C9H10O4 |