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Methyl 2-cyano-3-[2-(benzylthio)phenyl]propenoate
SpectraBase Compound ID 5Ec3zQvDtOU
InChI InChI=1S/C18H15NO2S/c1-21-18(20)16(12-19)11-15-9-5-6-10-17(15)22-13-14-7-3-2-4-8-14/h2-11H,13H2,1H3
InChIKey RRJMCQWPPQYKSR-UHFFFAOYSA-N
Mol Weight 309.38 g/mol
Molecular Formula C18H15NO2S
Exact Mass 309.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jv8CGxLmTb6
Name Methyl 2-cyano-3-[2-(benzylthio)phenyl]propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO2S
InChI InChI=1S/C18H15NO2S/c1-21-18(20)16(12-19)11-15-9-5-6-10-17(15)22-13-14-7-3-2-4-8-14/h2-11H,13H2,1H3
InChIKey RRJMCQWPPQYKSR-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.b06
Molecular Weight 309.383 g/mol
SMILES COC(C(=Cc1c(cccc1)SCc1ccccc1)C#N)=O
SPLASH splash10-0006-9311000000-95f4dc0e35b0540d5d9c
Source of Spectrum ARK-2007-70-14
Wiley ID 1871371