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Ethyl 2-(phenylthio)penta-3,4-dienoate
SpectraBase Compound ID TS9ucgXAJD
InChI InChI=1S/C13H14O2S/c1-3-8-12(13(14)15-4-2)16-11-9-6-5-7-10-11/h5-10,12H,1,4H2,2H3
InChIKey BIKSSSAJEDIQBH-UHFFFAOYSA-N
Mol Weight 234.31 g/mol
Molecular Formula C13H14O2S
Exact Mass 234.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CmBUfXyHdL
Name Ethyl 2-(phenylthio)penta-3,4-dienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.071450863 u
Formula C13H14O2S
GC Column Cyclosil-B (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 245oC
InChI InChI=1S/C13H14O2S/c1-3-8-12(13(14)15-4-2)16-11-9-6-5-7-10-11/h5-10,12H,1,4H2,2H3
InChIKey BIKSSSAJEDIQBH-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.201607278
Molecular Weight 234.313 g/mol
Quality 13
SMILES C(C)OC(C(C=C=C)SC1=CC=CC=C1)=O
SPLASH splash10-0002-9000000000-fc9ad20b026dc4f896b7
Source of Spectrum ACI-55-SM20-28 (DOI: 10.1002/anie.201607278)
Wiley ID 1908160