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7,7-Dimethyl-4-(phenylthio)-3-octene
SpectraBase Compound ID B3nwYR9wTTg
InChI InChI=1S/C16H24S/c1-5-9-14(12-13-16(2,3)4)17-15-10-7-6-8-11-15/h6-11H,5,12-13H2,1-4H3/b14-9+
InChIKey OCMXXRQQDITJCQ-NTEUORMPSA-N
Mol Weight 248.43 g/mol
Molecular Formula C16H24S
Exact Mass 248.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Df6hn6DaF8s
Name 7,7-Dimethyl-4-(phenylthio)-3-octene
Alternate Name(s) (1E)-1-(3,3-dimethylbutyl)-1-butenyl phenyl sulfide {[(1E)-1-(3,3-dimethylbutyl)-1-butenyl]sulfanyl}benzene
CAS Registry Number 122540-14-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24S
InChI InChI=1S/C16H24S/c1-5-9-14(12-13-16(2,3)4)17-15-10-7-6-8-11-15/h6-11H,5,12-13H2,1-4H3/b14-9+
InChIKey OCMXXRQQDITJCQ-NTEUORMPSA-N
Molecular Weight 248.428 g/mol
SMILES c1(S\C(=C\CC)CCC(C)(C)C)ccccc1
SPLASH splash10-0aba-7960000000-702344def62d78e65ddf
Source of Spectrum J-54-4253-5
Wiley ID 1251692