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Methyl 3-[2-(benzylthio)phenyl]propenoate
SpectraBase Compound ID IcU9p1grI73
InChI InChI=1S/C17H16O2S/c1-19-17(18)12-11-15-9-5-6-10-16(15)20-13-14-7-3-2-4-8-14/h2-12H,13H2,1H3
InChIKey XZZATAGURAQZID-UHFFFAOYSA-N
Mol Weight 284.37 g/mol
Molecular Formula C17H16O2S
Exact Mass 284.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FytdsUw1LAn
Name Methyl 3-[2-(benzylthio)phenyl]propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O2S
InChI InChI=1S/C17H16O2S/c1-19-17(18)12-11-15-9-5-6-10-16(15)20-13-14-7-3-2-4-8-14/h2-12H,13H2,1H3
InChIKey XZZATAGURAQZID-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.b06
Molecular Weight 284.373 g/mol
SMILES COC(C=Cc1c(cccc1)SCc1ccccc1)=O
SPLASH splash10-0006-7900000000-df4f7524697ce6cd9e8e
Source of Spectrum ARK-2007-70-11
Wiley ID 1871370