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3-(1-Benzothien-3-yl)-1-(3-ethoxyphenyl)-2-propen-1-one
SpectraBase Compound ID 7Ef50fAAwJG
InChI InChI=1S/C19H16O2S/c1-2-21-16-7-5-6-14(12-16)18(20)11-10-15-13-22-19-9-4-3-8-17(15)19/h3-13H,2H2,1H3/b11-10+
InChIKey SWUNUFQVAAOKNG-ZHACJKMWSA-N
Mol Weight 308.4 g/mol
Molecular Formula C19H16O2S
Exact Mass 308.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 136KMxTh7KU
Name 3-(1-Benzothien-3-yl)-1-(3-ethoxyphenyl)-2-propen-1-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O2S
InChI InChI=1S/C19H16O2S/c1-2-21-16-7-5-6-14(12-16)18(20)11-10-15-13-22-19-9-4-3-8-17(15)19/h3-13H,2H2,1H3/b11-10+
InChIKey SWUNUFQVAAOKNG-ZHACJKMWSA-N
Instrument Name Hewlett-Packard 5890-5970
Ionization Type EI
Literature Reference DOI 10.1021/jm501848m
Molecular Weight 308.395 g/mol
SMILES c1(cc(ccc1)C(=O)\C=C\c1c2c(sc1)cccc2)OCC
SPLASH splash10-014i-3913000000-6a10ae1be340eaf7512c
Source of Spectrum AF-58-1251-18
Wiley ID 1865554