Chem
J-GLOBAL ID：201807003393430175
Nikkaji number：J3.692.550G
(S)-5′-Methoxyspiro[2-cyclohexene-1,1′-tetralin]-4-one
(S)-5′-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/c1-18-15-6-2-5-14-13(15)4-3-9-16(14)10-7-12(17)8-11-16/h2,5-7,10H,3-4,8-9,11H2,1H3/t16-/m1/s1
InChI key：
DPKDCDFTTODJHW-MRXNPFEDSA-N
SMILES：
COc1cccc2c1CCC[C@]12CCC(=O)C=C1
Systematic name (3)：
- (S)-5′-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)-5'-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)-5'-methoxy-3',4'-dihydro-2'H-spiro[cyclohexane-1,1'-naphthalen]-2-en-4-one
- (S)-5′-Methoxyspiro[2-cyclohexene-1,1′-tetralin]-4-one
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