Chem
J-GLOBAL ID：201107083427764479
Nikkaji number：J2.940.187J
3-Hydroxy-4α-allyl-4-methylcycloheptanone
3-ヒドロキシ-4α-アリル-4-メチルシクロヘプタノン
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： C11H18O2
Molecular formula furigana： C11-H18-O2
Molecular weight： 182.263
InChI：
InChI=1S/C11H18O2/c1-3-6-11(2)7-4-5-9(12)8-10(11)13/h3,10,13H,1,4-8H2,2H3/t10?,11-/m1/s1
InChI key：
JADAHBFBLCSVNH-RRKGBCIJSA-N
SMILES：
C[C@@]1(CC=C)CCCC(=O)CC1O
Systematic name (3)：
- 3-ヒドロキシ-4α-アリル-4-メチルシクロヘプタノン
- (4S)-3-ヒドロキシ-4-メチル-4-(プロパ-2-エン-1-イル)シクロヘプタン-1-オン
- (4S)-3-hydroxy-4-methyl-4-(prop-2-en-1-yl)cycloheptan-1-one
- 3-Hydroxy-4α-allyl-4-methylcycloheptanone
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