Chem
J-GLOBAL ID：200907030737743710
Nikkaji number：J2.006K
Ethyl vanillin
エチルバニリン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C9H10O3
Molecular formula furigana： C9-H10-O3
Molecular weight： 166.176
InChI：
InChI=1S/C9H10O3/c1-2-12-9-5-7(6-10)3-4-8(9)11/h3-6,11H,2H2,1H3
InChI key：
CBOQJANXLMLOSS-UHFFFAOYSA-N
SMILES：
CCOc1cc(C=O)ccc1O
Systematic name (3)：
- 4-ヒドロキシ-3-エトキシベンズアルデヒド
- 3-エトキシ-4-ヒドロキシベンズアルデヒド
- 3-ethoxy-4-hydroxybenzaldehyde
- エチルバニリン
- Ethylvanillin
- 3-Ethoxy-4-hydroxybenzaldehyde
- エタバン
- ブルボナール
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Regulation number (4)：
- CU6125000
- (3)-1201
- EINECS2044647
- TSCA(121-32-4)
KEGG DRUG：
D01086
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