Chem
J-GLOBAL ID:200907026662180431   Nikkaji number:J470.279D

(1S)-1,2,6,6aα-Tetrahydro-3-methyl-1β-(phenylsulfonyl)pentalen-4(5H)-one

(1S)-1,2,6,6aα-テトラヒドロ-3-メチル-1β-(フェニルスルホニル)ペンタレン-4(5H)-オン
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: C15H16O3S
Molecular formula furigana: C15-H16-O3-S
Molecular weight: 276.350
InChI: InChI=1S/C15H16O3S/c1-10-9-14(12-7-8-13(16)15(10)12)19(17,18)11-5-3-2-4-6-11/h2-6,12,14H,7-9H2,1H3/t12-,14-/m0/s1
InChI key: DWKZXYVBMDWXDV-JSGCOSHPSA-N
SMILES: CC1=C2[C@@H](CCC2=O)[C@H](C1)S(=O)(=O)c1ccccc1
Systematic name  (3):
  • (1S)-1,2,6,6aα-テトラヒドロ-3-メチル-1β-(フェニルスルホニル)ペンタレン-4(5H)-オン
  • (3aR,4S)-4-(ベンゼンスルホニル)-6-メチル-1,2,3,3a,4,5-ヘキサヒドロペンタレン-1-オン
  • (3aR,4S)-4-(benzenesulfonyl)-6-methyl-1,2,3,3a,4,5-hexahydropentalen-1-one
Other name (1):
  • (1S)-1,2,6,6aα-Tetrahydro-3-methyl-1β-(phenylsulfonyl)pentalen-4(5H)-one
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