Chem
J-GLOBAL ID:200907026961418339   Nikkaji number:J1.199.941G

Methanesulfonic acid (E)-1-phenethyl-2-(p-tolylsulfinyl)-2-heptenyl ester

メタンスルホン酸(E)-1-フェネチル-2-(p-トリルスルフィニル)-2-ヘプテニル
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: C23H30O4S2
Molecular formula furigana: C23-H30-O4-S2
Molecular weight: 434.610
InChI: InChI=1S/C23H30O4S2/c1-4-5-7-12-23(28(24)21-16-13-19(2)14-17-21)22(27-29(3,25)26)18-15-20-10-8-6-9-11-20/h6,8-14,16-17,22H,4-5,7,15,18H2,1-3H3/b23-12+
InChI key: WIVZLICGSRXXGC-FSJBWODESA-N
SMILES: CCCC/C=C(\C(CCc1ccccc1)OS(=O)(=O)C)/S(=O)c1ccc(C)cc1
Systematic name  (3):
  • メタンスルホン酸(E)-1-フェネチル-2-(p-トリルスルフィニル)-2-ヘプテニル
  • (4E)-4-(4-メチルベンゼンスルフィニル)-1-フェニルノナ-4-エン-3-イル メタンスルホナート
  • (4E)-4-(4-methylbenzenesulfinyl)-1-phenylnon-4-en-3-yl methanesulfonate
Other name (1):
  • Methanesulfonic acid (E)-1-phenethyl-2-(p-tolylsulfinyl)-2-heptenyl ester
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