Chem
J-GLOBAL ID:200907025389536566
Nikkaji number:J1.318.219A
(4α)-1β,7,7-Trimethyl-3-(benzylthiomethyl)bicyclo[2.2.1]heptane-2-one
(4α)-1β,7,7-トリメチル-3-(ベンジルチオメチル)ビシクロ[2.2.1]ヘプタン-2-オン
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Substance type:
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
Molecular formula:
C18 H24 OS
Molecular formula furigana:
C18-H24-O-S
Molecular weight:
288.450
InChI:
InChI=1S/C18H24OS/c1-17(2)15-9-10-18(17,3)16(19)14(15)12-20-11-13-7-5-4-6-8-13/h4-8,14-15H,9-12H2,1-3H3/t14?,15-,18+/m1/s1
InChI key:
WOAMHKFFLCVURJ-MLMRRJNNSA-N
SMILES:
CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2CSCc1ccccc1
Systematic name (3):
(4α)-1β,7,7-トリメチル-3-(ベンジルチオメチル)ビシクロ[2.2.1]ヘプタン-2-オン
(1R,4R)-3-[(ベンジルスルファニル)メチル]-1,7,7-トリメチルビシクロ[2.2.1]ヘプタン-2-オン
(1R,4R)-3-[(benzylsulfanyl)methyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Other name (1):
(4α)-1β,7,7-Trimethyl-3-(benzylthiomethyl)bicyclo[2.2.1]heptane-2-one
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