Chem
J-GLOBAL ID：201807017776444146
Nikkaji number：J3.692.551E
(S)-7′-Methoxyspiro[2-cyclohexene-1,1′-tetralin]-4-one
(S)-7′-メトキシスピロ[2-シクロヘキセン-1,1′-テトラリン]-4-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： C16H18O2
Molecular formula furigana： C16-H18-O2
Molecular weight： 242.318
InChI：
InChI=1S/C16H18O2/c1-18-14-5-4-12-3-2-8-16(15(12)11-14)9-6-13(17)7-10-16/h4-6,9,11H,2-3,7-8,10H2,1H3/t16-/m1/s1
InChI key：
UYPFWUXVJHIAJG-MRXNPFEDSA-N
SMILES：
COc1ccc2CCC[C@@]3(CCC(=O)C=C3)c2c1
Systematic name (3)：
- (S)-7′-メトキシスピロ[2-シクロヘキセン-1,1′-テトラリン]-4-オン
- (1S)-7'-メトキシ-3',4'-ジヒドロ-2'H-スピロ[シクロヘキサン-1,1'-ナフタレン]-2-エン-4-オン
- (1S)-7'-methoxy-3',4'-dihydro-2'H-spiro[cyclohexane-1,1'-naphthalen]-2-en-4-one
- (S)-7′-Methoxyspiro[2-cyclohexene-1,1′-tetralin]-4-one
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