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Benzene, [(1-ethenyl-3-methyl-1-butenyl)thio]-, (E)-
SpectraBase Compound ID 9FowVXy6Ig
InChI InChI=1S/C13H16S/c1-4-12(10-11(2)3)14-13-8-6-5-7-9-13/h4-11H,1H2,2-3H3/b12-10+
InChIKey YFUJFQVCOXLYIF-ZRDIBKRKSA-N
Mol Weight 204.33 g/mol
Molecular Formula C13H16S
Exact Mass 204.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbLVYZcVzcA
Name Benzene, [(1-ethenyl-3-methyl-1-butenyl)thio]-, (E)-
Alternate Name(s) (1E)-3-methyl-1-vinyl-1-butenyl phenyl sulfide (E)-3-(phenylthio)-5-methyl-1,3-hexadiene {[(1E)-3-methyl-1-vinyl-1-butenyl]sulfanyl}benzene
CAS Registry Number 110027-09-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16S
InChI InChI=1S/C13H16S/c1-4-12(10-11(2)3)14-13-8-6-5-7-9-13/h4-11H,1H2,2-3H3/b12-10+
InChIKey YFUJFQVCOXLYIF-ZRDIBKRKSA-N
Molecular Weight 204.331 g/mol
SMILES C(\C=C/(Sc1ccccc1)C=C)(C)C
SPLASH splash10-004l-9110000000-c9b16292dc6bd251a88a
Source of Spectrum J-54-5817-7
Wiley ID 1202187