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2-Acetyl-4-(methylsulfanyl)-1-(3'-thienyl)hexa-1,3-dien-5-one
SpectraBase Compound ID FlkqzPBO914
InChI InChI=1S/C13H14O2S2/c1-9(14)12(6-11-4-5-17-8-11)7-13(16-3)10(2)15/h4-8H,1-3H3/b12-6-,13-7-
InChIKey NPNJIJNZDWBDFO-QXFGSWAMSA-N
Mol Weight 266.37 g/mol
Molecular Formula C13H14O2S2
Exact Mass 266.043522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPXTiw4KIAe
Name 2-Acetyl-4-(methylsulfanyl)-1-(3'-thienyl)hexa-1,3-dien-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2S2
InChI InChI=1S/C13H14O2S2/c1-9(14)12(6-11-4-5-17-8-11)7-13(16-3)10(2)15/h4-8H,1-3H3/b12-6-,13-7-
InChIKey NPNJIJNZDWBDFO-QXFGSWAMSA-N
Molecular Weight 266.373 g/mol
SMILES C(\C(=C\C(=C\c1cscc1)C(=O)C)SC)(=O)C
SPLASH splash10-0udi-0290000000-e2419914a3f9a0ba9f8b
Source of Spectrum F9-1988-1125-0
Synonyms (3Z,5Z)-3-(methylsulfanyl)-5-(3-thienylmethylene)-3-heptene-2,6-dione
Wiley ID 1565937