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2-(4-Methylphenyl)sulfinyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-one
SpectraBase Compound ID D8T70UG7Zdh
InChI InChI=1S/C17H22O2S/c1-12-6-9-14(10-7-12)20(19)16-11-8-13-4-2-3-5-15(13)17(16)18/h6-7,9-10,13,15-16H,2-5,8,11H2,1H3
InChIKey MYDGHWAVAPMIDW-UHFFFAOYSA-N
Mol Weight 290.42 g/mol
Molecular Formula C17H22O2S
Exact Mass 290.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgwGR6obaxK
Name 2-(4-Methylphenyl)sulfinyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-one
Alternate Name(s) 2-(p-tolylsulfinyl)decalin-1-one
CAS Registry Number 72967-96-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2S
InChI InChI=1S/C17H22O2S/c1-12-6-9-14(10-7-12)20(19)16-11-8-13-4-2-3-5-15(13)17(16)18/h6-7,9-10,13,15-16H,2-5,8,11H2,1H3
InChIKey MYDGHWAVAPMIDW-UHFFFAOYSA-N
Molecular Weight 290.421 g/mol
SMILES C1(S(c2ccc(cc2)C)=O)C(C2CCCCC2CC1)=O
SPLASH splash10-007o-9710000000-54db3fe4335c0349a350
Source of Spectrum J-45-1861-0
Wiley ID 1293673