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4,4-Dibenzoyl-5-thioxo-6-thianona-1,8-diene
SpectraBase Compound ID 1ukxKwcF8Lj
InChI InChI=1S/C22H20O2S2/c1-3-15-22(21(25)26-16-4-2,19(23)17-11-7-5-8-12-17)20(24)18-13-9-6-10-14-18/h3-14H,1-2,15-16H2
InChIKey GBJUBORVZLEVJL-UHFFFAOYSA-N
Mol Weight 380.52 g/mol
Molecular Formula C22H20O2S2
Exact Mass 380.090472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtPLftmFWOE
Name 4,4-Dibenzoyl-5-thioxo-6-thianona-1,8-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20O2S2
InChI InChI=1S/C22H20O2S2/c1-3-15-22(21(25)26-16-4-2,19(23)17-11-7-5-8-12-17)20(24)18-13-9-6-10-14-18/h3-14H,1-2,15-16H2
InChIKey GBJUBORVZLEVJL-UHFFFAOYSA-N
Molecular Weight 380.520 g/mol
SMILES C(C(=O)c1ccccc1)(C(=O)c1ccccc1)(C(=S)SCC=C)CC=C
SPLASH splash10-000i-0019000000-a4f1c22301085f90ca9a
Source of Spectrum SK-25-2309-3d
Synonyms 2,2-Dibenzoyl-4-pentenedithioic acid prop-2-enyl ester Prop-2-enyl 2,2-dibenzoylpent-4-enedithioate Allyl 2,2-dibenzoylpent-4-enedithioate Prop-2-enyl 2,2-bis(phenylcarbonyl)pent-4-enedithioate
Wiley ID 866769