Carbonyl compounds
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L-(-)-Sorbose 98.0+%, TCI America™
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CAS: 87-79-6 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00151097 InChI Key: BJHIKXHVCXFQLS-OTWZMJIISA-N Synonym: l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose PubChem CID: 6904 ChEBI: CHEBI:13172 IUPAC Name: (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O
| PubChem CID | 6904 |
|---|---|
| CAS | 87-79-6 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:13172 |
| MDL Number | MFCD00151097 |
| SMILES | C(C(C(C(C(=O)CO)O)O)O)O |
| Synonym | l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose |
| IUPAC Name | (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one |
| InChI Key | BJHIKXHVCXFQLS-OTWZMJIISA-N |
| Molecular Formula | C6H12O6 |
1-Phenacylpyridinium Bromide 98.0+%, TCI America™
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CAS: 16883-69-5 Molecular Formula: C13H12BrNO Molecular Weight (g/mol): 278.149 MDL Number: MFCD00031995 InChI Key: PXSUMUYPXZEXDT-UHFFFAOYSA-M Synonym: 1-phenacylpyridinium bromide,1-2-oxo-2-phenylethyl pyridin-1-ium bromide,n-phenacylpyridinium bromide,1-phenacylpyridiniumbromide,1-acetophenonepyridinium bromide,1-2-oxo-2-phenylethyl pyridinium bromide,1-2-oxo-2-phenyl-ethyl-pyridinium, bromide,phenacylpyridinium bromide,acmc-1c6a6,1-phenacyl-pyridinium bromide PubChem CID: 2798954 IUPAC Name: 1-phenyl-2-pyridin-1-ium-1-ylethanone;bromide SMILES: C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC=C2.[Br-]
| PubChem CID | 2798954 |
|---|---|
| CAS | 16883-69-5 |
| Molecular Weight (g/mol) | 278.149 |
| MDL Number | MFCD00031995 |
| SMILES | C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC=C2.[Br-] |
| Synonym | 1-phenacylpyridinium bromide,1-2-oxo-2-phenylethyl pyridin-1-ium bromide,n-phenacylpyridinium bromide,1-phenacylpyridiniumbromide,1-acetophenonepyridinium bromide,1-2-oxo-2-phenylethyl pyridinium bromide,1-2-oxo-2-phenyl-ethyl-pyridinium, bromide,phenacylpyridinium bromide,acmc-1c6a6,1-phenacyl-pyridinium bromide |
| IUPAC Name | 1-phenyl-2-pyridin-1-ium-1-ylethanone;bromide |
| InChI Key | PXSUMUYPXZEXDT-UHFFFAOYSA-M |
| Molecular Formula | C13H12BrNO |
2-Deoxy-2-fluoro-D-glucopyranose 98.0+%, TCI America™
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CAS: 29702-43-0 Molecular Formula: C6H11FO5 Molecular Weight (g/mol): 182.147 MDL Number: MFCD00077527 InChI Key: AOYNUTHNTBLRMT-SLPGGIOYSA-N Synonym: 2-Deoxy-2-fluoro-D-glucose PubChem CID: 170049 ChEBI: CHEBI:49135 IUPAC Name: (2R,3S,4R,5R)-2-fluoro-3,4,5,6-tetrahydroxyhexanal SMILES: C(C(C(C(C(C=O)F)O)O)O)O
| PubChem CID | 170049 |
|---|---|
| CAS | 29702-43-0 |
| Molecular Weight (g/mol) | 182.147 |
| ChEBI | CHEBI:49135 |
| MDL Number | MFCD00077527 |
| SMILES | C(C(C(C(C(C=O)F)O)O)O)O |
| Synonym | 2-Deoxy-2-fluoro-D-glucose |
| IUPAC Name | (2R,3S,4R,5R)-2-fluoro-3,4,5,6-tetrahydroxyhexanal |
| InChI Key | AOYNUTHNTBLRMT-SLPGGIOYSA-N |
| Molecular Formula | C6H11FO5 |
3'-Bromo-2'-methoxyacetophenone 98.0+%, TCI America™
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CAS: 267651-23-0 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD22573042 InChI Key: IBHCVANJIBGASI-UHFFFAOYSA-N Synonym: 1-(3-Bromo-2-methoxyphenyl)ethanone PubChem CID: 59544891 IUPAC Name: 1-(3-bromo-2-methoxyphenyl)ethanone SMILES: CC(=O)C1=C(C(=CC=C1)Br)OC
| PubChem CID | 59544891 |
|---|---|
| CAS | 267651-23-0 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD22573042 |
| SMILES | CC(=O)C1=C(C(=CC=C1)Br)OC |
| Synonym | 1-(3-Bromo-2-methoxyphenyl)ethanone |
| IUPAC Name | 1-(3-bromo-2-methoxyphenyl)ethanone |
| InChI Key | IBHCVANJIBGASI-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Pentadecanophenone 98.0+%, TCI America™
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CAS: 4669-04-9 Molecular Formula: C21H34O Molecular Weight (g/mol): 302.50 InChI Key: SDNCECLJQYEDRK-UHFFFAOYSA-N Synonym: Phenyl Tetradecyl Ketone PubChem CID: 259220 IUPAC Name: 1-phenylpentadecan-1-one SMILES: CCCCCCCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 259220 |
|---|---|
| CAS | 4669-04-9 |
| Molecular Weight (g/mol) | 302.50 |
| SMILES | CCCCCCCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | Phenyl Tetradecyl Ketone |
| IUPAC Name | 1-phenylpentadecan-1-one |
| InChI Key | SDNCECLJQYEDRK-UHFFFAOYSA-N |
| Molecular Formula | C21H34O |
Bis(benzoylmethyl) Sulfide 99.0+%, TCI America™
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CAS: 2461-80-5 Molecular Formula: C16H14O2S Molecular Weight (g/mol): 270.346 MDL Number: MFCD00054497 InChI Key: LHSKVFSCEMNSEC-UHFFFAOYSA-N PubChem CID: 249751 IUPAC Name: 2-phenacylsulfanyl-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CSCC(=O)C2=CC=CC=C2
| PubChem CID | 249751 |
|---|---|
| CAS | 2461-80-5 |
| Molecular Weight (g/mol) | 270.346 |
| MDL Number | MFCD00054497 |
| SMILES | C1=CC=C(C=C1)C(=O)CSCC(=O)C2=CC=CC=C2 |
| IUPAC Name | 2-phenacylsulfanyl-1-phenylethanone |
| InChI Key | LHSKVFSCEMNSEC-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2S |
3-Bromopyruvic Acid 98.0+%, TCI America™
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CAS: 1113-59-3 Molecular Formula: C3H3BrO3 Molecular Weight (g/mol): 166.958 MDL Number: MFCD00002587 InChI Key: PRRZDZJYSJLDBS-UHFFFAOYSA-N Synonym: 3-bromopyruvic acid,bromopyruvic acid,bromopyruvate,3-bromopyruvate,3-bromo-2-oxopropionic acid,bromopyruvicacid,pyruvic acid, bromo,propanoic acid, 3-bromo-2-oxo,unii-63jmv04grk,.beta.-bromopyruvic acid PubChem CID: 70684 IUPAC Name: 3-bromo-2-oxopropanoic acid SMILES: C(C(=O)C(=O)O)Br
| PubChem CID | 70684 |
|---|---|
| CAS | 1113-59-3 |
| Molecular Weight (g/mol) | 166.958 |
| MDL Number | MFCD00002587 |
| SMILES | C(C(=O)C(=O)O)Br |
| Synonym | 3-bromopyruvic acid,bromopyruvic acid,bromopyruvate,3-bromopyruvate,3-bromo-2-oxopropionic acid,bromopyruvicacid,pyruvic acid, bromo,propanoic acid, 3-bromo-2-oxo,unii-63jmv04grk,.beta.-bromopyruvic acid |
| IUPAC Name | 3-bromo-2-oxopropanoic acid |
| InChI Key | PRRZDZJYSJLDBS-UHFFFAOYSA-N |
| Molecular Formula | C3H3BrO3 |
2,3-Dihydroxybenzaldehyde 98.0+%, TCI America™
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CAS: 24677-78-9 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.122 MDL Number: MFCD00003324 InChI Key: IXWOUPGDGMCKGT-UHFFFAOYSA-N Synonym: o-pyrocatechualdehyde,5,6-dihydroxybenzaldehyde,benzaldehyde, 2,3-dihydroxy,benzaldehyde, dihydroxy,2,3-dihydroxybenzaldehyde,dihydroxybenzaldehyde,pubchem6561,acmc-1clux,2,3-dihydroxy benzaldehyde,2,3-dihydroxy-benzaldehyde PubChem CID: 90579 ChEBI: CHEBI:50197 IUPAC Name: 2,3-dihydroxybenzaldehyde SMILES: C1=CC(=C(C(=C1)O)O)C=O
| PubChem CID | 90579 |
|---|---|
| CAS | 24677-78-9 |
| Molecular Weight (g/mol) | 138.122 |
| ChEBI | CHEBI:50197 |
| MDL Number | MFCD00003324 |
| SMILES | C1=CC(=C(C(=C1)O)O)C=O |
| Synonym | o-pyrocatechualdehyde,5,6-dihydroxybenzaldehyde,benzaldehyde, 2,3-dihydroxy,benzaldehyde, dihydroxy,2,3-dihydroxybenzaldehyde,dihydroxybenzaldehyde,pubchem6561,acmc-1clux,2,3-dihydroxy benzaldehyde,2,3-dihydroxy-benzaldehyde |
| IUPAC Name | 2,3-dihydroxybenzaldehyde |
| InChI Key | IXWOUPGDGMCKGT-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
2,6-Pyridinedicarboxaldehyde 98.0+%, TCI America™
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CAS: 5431-44-7 Molecular Formula: C7H5NO2 Molecular Weight (g/mol): 135.122 MDL Number: MFCD00010103 InChI Key: PMWXGSWIOOVHEQ-UHFFFAOYSA-N Synonym: 2,6-pyridinedicarboxaldehyde,2,6-diformylpyridine,2,6-pyridine dialdehyde,2,6-pyridinedicarbaldehyde,pubchem22285,acmc-1ap0d,pyda72,2,6-pyridinedicarboxadehyde,2,6-pyridine dicarboxaldehyde,2,6-pyridinedicarbaldehyde # PubChem CID: 79485 IUPAC Name: pyridine-2,6-dicarbaldehyde SMILES: C1=CC(=NC(=C1)C=O)C=O
| PubChem CID | 79485 |
|---|---|
| CAS | 5431-44-7 |
| Molecular Weight (g/mol) | 135.122 |
| MDL Number | MFCD00010103 |
| SMILES | C1=CC(=NC(=C1)C=O)C=O |
| Synonym | 2,6-pyridinedicarboxaldehyde,2,6-diformylpyridine,2,6-pyridine dialdehyde,2,6-pyridinedicarbaldehyde,pubchem22285,acmc-1ap0d,pyda72,2,6-pyridinedicarboxadehyde,2,6-pyridine dicarboxaldehyde,2,6-pyridinedicarbaldehyde # |
| IUPAC Name | pyridine-2,6-dicarbaldehyde |
| InChI Key | PMWXGSWIOOVHEQ-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO2 |
Sodium Anthraquinone-1-sulfonate 98.0+%, TCI America™
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CAS: 128-56-3 Molecular Formula: C14H7NaO5S Molecular Weight (g/mol): 310.255 MDL Number: MFCD00037145 InChI Key: SDKPSXWGRWWLKR-UHFFFAOYSA-M Synonym: Anthraquinone-1-sulfonic Acid Sodium Salt PubChem CID: 517266 IUPAC Name: sodium;9,10-dioxoanthracene-1-sulfonate SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[Na+]
| PubChem CID | 517266 |
|---|---|
| CAS | 128-56-3 |
| Molecular Weight (g/mol) | 310.255 |
| MDL Number | MFCD00037145 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[Na+] |
| Synonym | Anthraquinone-1-sulfonic Acid Sodium Salt |
| IUPAC Name | sodium;9,10-dioxoanthracene-1-sulfonate |
| InChI Key | SDKPSXWGRWWLKR-UHFFFAOYSA-M |
| Molecular Formula | C14H7NaO5S |
6-Bromo-3-formylchromone 97.0+%, TCI America™
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CAS: 52817-12-6 Molecular Formula: C10H5BrO3 Molecular Weight (g/mol): 253.05 MDL Number: MFCD00191849 InChI Key: PCEZXSJBHMOQFT-UHFFFAOYSA-N PubChem CID: 614309 IUPAC Name: 6-bromo-4-oxo-4H-chromene-3-carbaldehyde SMILES: BrC1=CC=C2OC=C(C=O)C(=O)C2=C1
| PubChem CID | 614309 |
|---|---|
| CAS | 52817-12-6 |
| Molecular Weight (g/mol) | 253.05 |
| MDL Number | MFCD00191849 |
| SMILES | BrC1=CC=C2OC=C(C=O)C(=O)C2=C1 |
| IUPAC Name | 6-bromo-4-oxo-4H-chromene-3-carbaldehyde |
| InChI Key | PCEZXSJBHMOQFT-UHFFFAOYSA-N |
| Molecular Formula | C10H5BrO3 |
1,4-Diphenyl-1,4-butanedione 98.0+%, TCI America™
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CAS: 495-71-6 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 InChI Key: OSWWFLDIIGGSJV-UHFFFAOYSA-N Synonym: 1,2-dibenzoylethane,1,4-diphenyl-1,4-butanedione,1,4-butanedione, 1,4-diphenyl,biphenacyl,diphenacyl,2,2-biacetophenone,acmc-1bd9f,ethane, 1,2-dibenzoyl,succinophenone diphenacyl,cambridge id 5102527 PubChem CID: 136322 IUPAC Name: 1,4-diphenylbutane-1,4-dione SMILES: C1=CC=C(C=C1)C(=O)CCC(=O)C2=CC=CC=C2
| PubChem CID | 136322 |
|---|---|
| CAS | 495-71-6 |
| Molecular Weight (g/mol) | 238.286 |
| SMILES | C1=CC=C(C=C1)C(=O)CCC(=O)C2=CC=CC=C2 |
| Synonym | 1,2-dibenzoylethane,1,4-diphenyl-1,4-butanedione,1,4-butanedione, 1,4-diphenyl,biphenacyl,diphenacyl,2,2-biacetophenone,acmc-1bd9f,ethane, 1,2-dibenzoyl,succinophenone diphenacyl,cambridge id 5102527 |
| IUPAC Name | 1,4-diphenylbutane-1,4-dione |
| InChI Key | OSWWFLDIIGGSJV-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2 |
Ethyl (4-Fluorobenzoyl)acetate 98.0+%, TCI America™
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CAS: 1999-00-4 Molecular Formula: C11H11FO3 Molecular Weight (g/mol): 210.204 MDL Number: MFCD03093631 InChI Key: SJUXLKYJKQBZLM-UHFFFAOYSA-N Synonym: ethyl 3-4-fluorophenyl-3-oxopropanoate,ethyl 4-fluorobenzoylacetate,ethyl 4-fluorobenzoyl acetate,4-fluorobenzoylacetic acid ethyl ester,ethyl p-fluorobenzoyl acetate,4-fluorobenzoyl acetic acid ethyl ester,ethyl 3-4-fluorophenyl-3-oxopropionate,ethyl 3-4'-fluorophenyl-3-oxopropanoate,ethyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid ethyl ester PubChem CID: 2758844 IUPAC Name: ethyl 3-(4-fluorophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)F
| PubChem CID | 2758844 |
|---|---|
| CAS | 1999-00-4 |
| Molecular Weight (g/mol) | 210.204 |
| MDL Number | MFCD03093631 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)F |
| Synonym | ethyl 3-4-fluorophenyl-3-oxopropanoate,ethyl 4-fluorobenzoylacetate,ethyl 4-fluorobenzoyl acetate,4-fluorobenzoylacetic acid ethyl ester,ethyl p-fluorobenzoyl acetate,4-fluorobenzoyl acetic acid ethyl ester,ethyl 3-4-fluorophenyl-3-oxopropionate,ethyl 3-4'-fluorophenyl-3-oxopropanoate,ethyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid ethyl ester |
| IUPAC Name | ethyl 3-(4-fluorophenyl)-3-oxopropanoate |
| InChI Key | SJUXLKYJKQBZLM-UHFFFAOYSA-N |
| Molecular Formula | C11H11FO3 |
1-Indanone 98.0+%, TCI America™
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CAS: 83-33-0 Molecular Formula: C9H8O Molecular Weight (g/mol): 132.162 MDL Number: MFCD00003785 InChI Key: QNXSIUBBGPHDDE-UHFFFAOYSA-N Synonym: 1-indanone,indan-1-one,2,3-dihydro-1h-inden-1-one,indanone,alpha-indanone,alpha-hydrindone,1h-inden-1-one, 2,3-dihydro,1-indone,hydrindone,.alpha.-indanone PubChem CID: 6735 ChEBI: CHEBI:17404 IUPAC Name: 2,3-dihydroinden-1-one SMILES: C1CC(=O)C2=CC=CC=C21
| PubChem CID | 6735 |
|---|---|
| CAS | 83-33-0 |
| Molecular Weight (g/mol) | 132.162 |
| ChEBI | CHEBI:17404 |
| MDL Number | MFCD00003785 |
| SMILES | C1CC(=O)C2=CC=CC=C21 |
| Synonym | 1-indanone,indan-1-one,2,3-dihydro-1h-inden-1-one,indanone,alpha-indanone,alpha-hydrindone,1h-inden-1-one, 2,3-dihydro,1-indone,hydrindone,.alpha.-indanone |
| IUPAC Name | 2,3-dihydroinden-1-one |
| InChI Key | QNXSIUBBGPHDDE-UHFFFAOYSA-N |
| Molecular Formula | C9H8O |
5,6-Dimethoxy-1-indanone 98.0+%, TCI America™
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CAS: 2107-69-9 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 InChI Key: IHMQOBPGHZFGLC-UHFFFAOYSA-N Synonym: 5,6-dimethoxy-1-indanone,5,6-dimethoxy-2,3-dihydro-1h-inden-1-one,5,6-dimethoxyindan-1-one,5,6-dimethoxy-indan-1-one,1h-inden-1-one, 2,3-dihydro-5,6-dimethoxy,5,6-dimethoxyindanone,unii-f805rzi8go,f805rzi8go,1-indanone, 5,6-dimethoxy,5,6-dimethoxyindan-1-on PubChem CID: 75018 IUPAC Name: 5,6-dimethoxy-2,3-dihydroinden-1-one SMILES: COC1=C(C=C2C(=C1)CCC2=O)OC
| PubChem CID | 75018 |
|---|---|
| CAS | 2107-69-9 |
| Molecular Weight (g/mol) | 192.214 |
| SMILES | COC1=C(C=C2C(=C1)CCC2=O)OC |
| Synonym | 5,6-dimethoxy-1-indanone,5,6-dimethoxy-2,3-dihydro-1h-inden-1-one,5,6-dimethoxyindan-1-one,5,6-dimethoxy-indan-1-one,1h-inden-1-one, 2,3-dihydro-5,6-dimethoxy,5,6-dimethoxyindanone,unii-f805rzi8go,f805rzi8go,1-indanone, 5,6-dimethoxy,5,6-dimethoxyindan-1-on |
| IUPAC Name | 5,6-dimethoxy-2,3-dihydroinden-1-one |
| InChI Key | IHMQOBPGHZFGLC-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |