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5-Phenyl-1,1-bis(methylthio)-3-hydroxy-1,3-pentadien-5-one
SpectraBase Compound ID 1uKSOgXfOef
InChI InChI=1S/C13H14O2S2/c1-16-13(17-2)9-11(14)8-12(15)10-6-4-3-5-7-10/h3-9,14H,1-2H3/b11-8-
InChIKey DBZUULWIZSVCIA-FLIBITNWSA-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 2Ze5fA8FkW
Name 5-Phenyl-1,1-bis(methylthio)-3-hydroxy-1,3-pentadien-5-one
Alternate Name(s) (2Z)-3-hydroxy-5,5-bis(methylsulfanyl)-1-phenyl-2,4-pentadien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2S2
InChI InChI=1S/C13H14O2S2/c1-16-13(17-2)9-11(14)8-12(15)10-6-4-3-5-7-10/h3-9,14H,1-2H3/b11-8-
InChIKey DBZUULWIZSVCIA-FLIBITNWSA-N
Molecular Weight 266.373 g/mol
SMILES O\C(C=C(SC)SC)=C/C(=O)c1ccccc1
SPLASH splash10-00os-9580000000-2fc2738fbd5f18cb7919
Source of Spectrum SO-0-874-3
Wiley ID 1539546