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[(S)R,1E,3E]-1-Phenylsulfonyl-4-p-tolylsulfinyl-1,3-butadiene
SpectraBase Compound ID HsW1enl69ck
InChI InChI=1S/C17H16O3S2/c1-15-9-11-16(12-10-15)21(18)13-5-6-14-22(19,20)17-7-3-2-4-8-17/h2-14H,1H3/b13-5+,14-6+
InChIKey NQFSERRRYLZVKP-ACFHMISVSA-N
Mol Weight 332.43 g/mol
Molecular Formula C17H16O3S2
Exact Mass 332.054087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6AG0Uzt8BjS
Name [(S)R,1E,3E]-1-Phenylsulfonyl-4-p-tolylsulfinyl-1,3-butadiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O3S2
InChI InChI=1S/C17H16O3S2/c1-15-9-11-16(12-10-15)21(18)13-5-6-14-22(19,20)17-7-3-2-4-8-17/h2-14H,1H3/b13-5+,14-6+
InChIKey NQFSERRRYLZVKP-ACFHMISVSA-N
Molecular Weight 332.432 g/mol
SMILES c1([S@](\C=C\C=C\S(=O)(=O)c2ccccc2)=O)ccc(cc1)C
SPLASH splash10-004l-4910000000-56154eea11dcb387e7c6
Source of Spectrum QC-6-1762-1
Synonyms (1E,3E)-4-[(4-methylphenyl)sulfinyl]-1,3-butadienyl phenyl sulfone 1-Methyl-4-{[(1E,3E)-4-(phenylsulfonyl)-1,3-butadienyl]sulfinyl}benzene
Wiley ID 868971