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(3aS,4S,7aS)-7a-ethyl-4-(ethylsulfonylmethyl)-2,3,3a,4,6,7-hexahydroindene-1,5-dione
SpectraBase Compound ID 918ICJWKotz
InChI InChI=1S/C14H22O4S/c1-3-14-8-7-12(15)10(9-19(17,18)4-2)11(14)5-6-13(14)16/h10-11H,3-9H2,1-2H3/t10-,11-,14-/m0/s1
InChIKey ISZNPDLIJFKMNC-MJVIPROJSA-N
Mol Weight 286.39 g/mol
Molecular Formula C14H22O4S
Exact Mass 286.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAUt06Xi2if
Name (3aS,4S,7aS)-7a-ethyl-4-(ethylsulfonylmethyl)-2,3,3a,4,6,7-hexahydroindene-1,5-dione
Alternate Name(s) (3aS,4S,7aS)-7a-ethyl-4-((ethylsulfonyl)methyl)hexahydro-1H-indene-1,5(4H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4S
InChI InChI=1S/C14H22O4S/c1-3-14-8-7-12(15)10(9-19(17,18)4-2)11(14)5-6-13(14)16/h10-11H,3-9H2,1-2H3/t10-,11-,14-/m0/s1
InChIKey ISZNPDLIJFKMNC-MJVIPROJSA-N
Molecular Weight 286.386 g/mol
SMILES [C@]12([C@@](C(CC2)=O)(CCC(=O)[C@]1(CS(CC)(=O)=O)[H])CC)[H]
SPLASH splash10-0a4i-9200000000-297db0ed2f8dc709d790
Source of Spectrum SI-4-235-21a
Wiley ID 1813360