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(Z)Methyl 3-(Phenylthio)-4-(methoxycarbonyl)but-2-enoate
SpectraBase Compound ID HzQ85KGDVd4
InChI InChI=1S/C13H14O4S/c1-16-12(14)8-11(9-13(15)17-2)18-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3/b11-8-
InChIKey JWOPMCZHYGYOFX-FLIBITNWSA-N
Mol Weight 266.31 g/mol
Molecular Formula C13H14O4S
Exact Mass 266.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5QHd9sGt0E
Name (Z)Methyl 3-(Phenylthio)-4-(methoxycarbonyl)but-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4S
InChI InChI=1S/C13H14O4S/c1-16-12(14)8-11(9-13(15)17-2)18-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3/b11-8-
InChIKey JWOPMCZHYGYOFX-FLIBITNWSA-N
Molecular Weight 266.311 g/mol
SMILES C(\C(=C\C(=O)OC)Sc1ccccc1)C(=O)OC
SPLASH splash10-07dt-2960000000-a781817794b205239e90
Source of Spectrum J-58-6515-5
Synonyms Dimethyl (2Z)-3-(phenylsulfanyl)-2-pentenedioate
Wiley ID 1269665