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(Z)-4-Phenyl-4-(toluene-4-sulfonyl)-but-3-en-2-one
SpectraBase Compound ID cxESTTJ2uO
InChI InChI=1S/C17H16O3S/c1-13-8-10-16(11-9-13)21(19,20)17(12-14(2)18)15-6-4-3-5-7-15/h3-12H,1-2H3/b17-12-
InChIKey RLXTVZBWWNYGJV-ATVHPVEESA-N
Mol Weight 300.37 g/mol
Molecular Formula C17H16O3S
Exact Mass 300.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3U9FrrDmFud
Name (Z)-4-Phenyl-4-(toluene-4-sulfonyl)-but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O3S
InChI InChI=1S/C17H16O3S/c1-13-8-10-16(11-9-13)21(19,20)17(12-14(2)18)15-6-4-3-5-7-15/h3-12H,1-2H3/b17-12-
InChIKey RLXTVZBWWNYGJV-ATVHPVEESA-N
Molecular Weight 300.372 g/mol
SMILES C(\C=C\(S(c1ccc(cc1)C)(=O)=O)c1ccccc1)(=O)C
SPLASH splash10-0006-9710000000-1bc60c8cd4aeba840b6d
Source of Spectrum Y1-45-4566-4
Synonyms (3Z)-4-[(4-methylphenyl)sulfonyl]-4-phenyl-3-buten-2-one (E)-Ethyl 3-(p-tolylsulfonyl)-3-phenyl-3-buten-2-one
Wiley ID 1621974