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Benzenepropanoic acid, .beta.-[[[(methylthio)phenylmethylene]amino]m ethyl]-, methyl ester
SpectraBase Compound ID KeGY8ZyKJOT
InChI InChI=1S/C19H21NO2S/c1-22-18(21)13-17(15-9-5-3-6-10-15)14-20-19(23-2)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3/b20-19-
InChIKey LCBYGRVSANDDLT-VXPUYCOJSA-N
Mol Weight 327.44 g/mol
Molecular Formula C19H21NO2S
Exact Mass 327.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqM6T6vVryQ
Name Benzenepropanoic acid, .beta.-[[[(methylthio)phenylmethylene]amino]m ethyl]-, methyl ester
CAS Registry Number 107942-35-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO2S
InChI InChI=1S/C19H21NO2S/c1-22-18(21)13-17(15-9-5-3-6-10-15)14-20-19(23-2)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3/b20-19-
InChIKey LCBYGRVSANDDLT-VXPUYCOJSA-N
Molecular Weight 327.442 g/mol
SMILES c1(\C(=N\CC(CC(=O)OC)c2ccccc2)SC)ccccc1
SPLASH splash10-017i-1920000000-daf5be8a3462176b02a9
Source of Spectrum J-52-2529-13
Synonyms (2-phenyl-3-methoxycarbonylpropyl)imino-phenyl-methylsufenyl-methane Methyl 4-{[(Z)-(methylsulfanyl)(phenyl)methylidene]amino}-3-phenylbutanoate
Wiley ID 1325558