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2-(Phenylseleno)-3-(p-toluenesulfonyl)-1,3-butadiene
SpectraBase Compound ID KA1aRYygQzU
InChI InChI=1S/C17H16O2SSe/c1-13-9-11-16(12-10-13)20(18,19)14(2)15(3)21-17-7-5-4-6-8-17/h4-12H,2-3H2,1H3
InChIKey KVNXAQFCYXXXHV-UHFFFAOYSA-N
Mol Weight 363.34 g/mol
Molecular Formula C17H16O2SSe
Exact Mass 364.003623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AANlwqTybBA
Name 2-(Phenylseleno)-3-(p-toluenesulfonyl)-1,3-butadiene
CAS Registry Number 127381-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O2SSe
InChI InChI=1S/C17H16O2SSe/c1-13-9-11-16(12-10-13)20(18,19)14(2)15(3)21-17-7-5-4-6-8-17/h4-12H,2-3H2,1H3
InChIKey KVNXAQFCYXXXHV-UHFFFAOYSA-N
Molecular Weight 363.345 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(C([Se]c1ccccc1)=C)=C
SPLASH splash10-0006-9600000000-60834b66651ca2b1457e
Source of Spectrum J-55-4600-22
Synonyms 1-Methyl-4-{[1-methylene-2-(phenylselanyl)-2-propenyl]sulfonyl}benzene 1-Methylene-2-(phenylselanyl)-2-propenyl 4-methylphenyl sulfone
Wiley ID 1350599