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2,3-Butadien-1-ol, 2-methyl-4-[(4-methylphenyl)sulfonyl]-, (.+-.)-
SpectraBase Compound ID ClPyaspO6qe
InChI InChI=1S/C12H14O3S/c1-10-3-5-12(6-4-10)16(14,15)8-7-11(2)9-13/h3-6,8,13H,9H2,1-2H3
InChIKey UMQHLVYCCQKYJZ-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56FSbF1gDLt
Name 2,3-Butadien-1-ol, 2-methyl-4-[(4-methylphenyl)sulfonyl]-, (.+-.)-
CAS Registry Number 127381-42-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-10-3-5-12(6-4-10)16(14,15)8-7-11(2)9-13/h3-6,8,13H,9H2,1-2H3
InChIKey UMQHLVYCCQKYJZ-UHFFFAOYSA-N
Molecular Weight 238.301 g/mol
SMILES OCC(=C=CS(c1ccc(cc1)C)(=O)=O)C
SPLASH splash10-0006-9200000000-f66b01d02298f77275f3
Source of Spectrum J-55-4600-20
Synonyms 2-Methyl-4-[(4-methylphenyl)sulfonyl]-2,3-butadien-1-ol
Wiley ID 1240245