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Benzeneethanimidothioic acid, .alpha.-(acetyloxy)-4-chloro-.alpha.-cyano-N-phenyl-, methyl ester
SpectraBase Compound ID GVF5kFYuLls
InChI InChI=1S/C18H15ClN2O2S/c1-13(22)23-18(12-20,14-8-10-15(19)11-9-14)17(24-2)21-16-6-4-3-5-7-16/h3-11H,1-2H3/b21-17-
InChIKey QXGNSHAJUFTLET-FXBPSFAMSA-N
Mol Weight 358.84 g/mol
Molecular Formula C18H15ClN2O2S
Exact Mass 358.054277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 261Wsf4uidN
Name Benzeneethanimidothioic acid, .alpha.-(acetyloxy)-4-chloro-.alpha.-cyano-N-phenyl-, methyl ester
CAS Registry Number 115351-43-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15ClN2O2S
InChI InChI=1S/C18H15ClN2O2S/c1-13(22)23-18(12-20,14-8-10-15(19)11-9-14)17(24-2)21-16-6-4-3-5-7-16/h3-11H,1-2H3/b21-17-
InChIKey QXGNSHAJUFTLET-FXBPSFAMSA-N
Molecular Weight 358.843 g/mol
SMILES C(\C(=N\c1ccccc1)SC)(C#N)(OC(=O)C)c1ccc(cc1)Cl
SPLASH splash10-0zfs-0039000000-db7ce6745df1c89e3874
Source of Spectrum KC-1988-173-5
Synonyms (2Z)-1-(4-chlorophenyl)-1-cyano-2-(methylsulfanyl)-2-(phenylimino)ethyl acetate 1-(1-Acetoxy-1-cyano-2-methylthio-2-phenylimino-ethyl)-4-chloro-benzene
Wiley ID 1346904