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Benzenemethanol, .alpha.-methyl-.alpha.-(2-methyl-3-methylthio-2-propenyl)-
SpectraBase Compound ID Jdl8liS7FXE
InChI InChI=1S/C13H18OS/c1-11(10-15-3)9-13(2,14)12-7-5-4-6-8-12/h4-8,10,14H,9H2,1-3H3/b11-10+
InChIKey MLAMIGMYUPNDBM-ZHACJKMWSA-N
Mol Weight 222.35 g/mol
Molecular Formula C13H18OS
Exact Mass 222.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Wh9eRJ8QVo
Name Benzenemethanol, .alpha.-methyl-.alpha.-(2-methyl-3-methylthio-2-propenyl)-
CAS Registry Number 97369-97-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18OS
InChI InChI=1S/C13H18OS/c1-11(10-15-3)9-13(2,14)12-7-5-4-6-8-12/h4-8,10,14H,9H2,1-3H3/b11-10+
InChIKey MLAMIGMYUPNDBM-ZHACJKMWSA-N
Molecular Weight 222.346 g/mol
SMILES OC(c1ccccc1)(C)C\C(C)=C\SC
SPLASH splash10-0fdo-9700000000-30fe1dbb3ba3ac68acf7
Synonyms (4E)-4-Methyl-5-(methylsulfanyl)-2-phenyl-4-penten-2-ol (E)-4-methyl-5-(methylthio)-2-phenyl-4-penten-2-ol (E)-4-methyl-5-(methylthio)-2-phenyl-pent-4-en-2-ol (E)-4-methyl-5-methylsulfanyl-2-phenyl-pent-4-en-2-ol
Wiley ID 1484794