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Cyclohexene, 1,3,3-trimethyl-2-[1-(methylthio)-1,3-butadienyl]-, (E)-
SpectraBase Compound ID Jiz3p9kH7Zo
InChI InChI=1S/C14H22S/c1-6-8-12(15-5)13-11(2)9-7-10-14(13,3)4/h6,8H,1,7,9-10H2,2-5H3/b12-8-
InChIKey QNQCAOAFBGUESN-WQLSENKSSA-N
Mol Weight 222.39 g/mol
Molecular Formula C14H22S
Exact Mass 222.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9ofDfW6U8e
Name Cyclohexene, 1,3,3-trimethyl-2-[1-(methylthio)-1,3-butadienyl]-, (E)-
Alternate Name(s) 1,3,3-trimethyl-2-[(1Z)-1-(methylsulfanyl)-1,3-butadienyl]-1-cyclohexene 2,6,6-Trimethyl-1-(1-methylthio-(E)1,3-butadien-1-yl)-1=cyclohexene Methyl (1Z)-1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3-butadienyl sulfide
CAS Registry Number 121067-36-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22S
InChI InChI=1S/C14H22S/c1-6-8-12(15-5)13-11(2)9-7-10-14(13,3)4/h6,8H,1,7,9-10H2,2-5H3/b12-8-
InChIKey QNQCAOAFBGUESN-WQLSENKSSA-N
Molecular Weight 222.390 g/mol
SMILES C1(\C(=C\C=C)SC)=C(CCCC1(C)C)C
SPLASH splash10-0a4l-9670000000-3664cc8598969bdc6848
Source of Spectrum F-44-1989-13
Wiley ID 1223020