Chem
J-GLOBAL ID：201307014621565218
Nikkaji number：J3.177.243E
(7S)-1-Phenyl-7,11-dimethyl-10-dodecene-1,4-diyne-3-one
(7S)-1-フェニル-7,11-ジメチル-10-ドデセン-1,4-ジイン-3-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： C20H22O
Molecular formula furigana： C20-H22-O
Molecular weight： 278.395
InChI：
InChI=1S/C20H22O/c1-17(2)9-7-10-18(3)11-8-14-20(21)16-15-19-12-5-4-6-13-19/h4-6,9,12-13,18H,7,10-11H2,1-3H3/t18-/m0/s1
InChI key：
BKYNKUAQMSCXJR-SFHVURJKSA-N
SMILES：
C[C@@H](CCC=C(C)C)CC#CC(=O)C#Cc1ccccc1
Systematic name (3)：
- (7S)-1-フェニル-7,11-ジメチル-10-ドデセン-1,4-ジイン-3-オン
- (7S)-7,11-ジメチル-1-フェニルドデカ-10-エン-1,4-ジイン-3-オン
- (7S)-7,11-dimethyl-1-phenyldodec-10-en-1,4-diyn-3-one
- (7S)-1-Phenyl-7,11-dimethyl-10-dodecene-1,4-diyne-3-one
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