Chem
J-GLOBAL ID：200907086236050213
Nikkaji number：J1.690.163F
3β-Methyl-4β-propionyl-3,4-dihydro-2H-1-benzopyran-2-one
3β-メチル-4β-プロピオニル-3,4-ジヒドロ-2H-1-ベンゾピラン-2-オン
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： C13H14O3
Molecular formula furigana： C13-H14-O3
Molecular weight： 218.252
InChI：
InChI=1S/C13H14O3/c1-3-10(14)12-8(2)13(15)16-11-7-5-4-6-9(11)12/h4-8,12H,3H2,1-2H3/t8-,12+/m0/s1
InChI key：
JIENMYRLPMQVTM-QPUJVOFHSA-N
SMILES：
CCC(=O)[C@@H]1[C@H](C)C(=O)Oc2ccccc12
Systematic name (3)：
- 3β-メチル-4β-プロピオニル-3,4-ジヒドロ-2H-1-ベンゾピラン-2-オン
- (3S,4R)-3-メチル-4-プロパノイル-3,4-ジヒドロ-2H-1-ベンゾピラン-2-オン
- (3S,4R)-3-methyl-4-propanoyl-3,4-dihydro-2H-1-benzopyran-2-one
- 3β-Methyl-4β-propionyl-3,4-dihydro-2H-1-benzopyran-2-one
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