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2-Propenethioic acid, 3-phenyl-3-[(phenylthioxomethyl)amino]-, S-phenyl ester
SpectraBase Compound ID 43Z7ZpocQR9
InChI InChI=1S/C22H17NOS2/c24-21(26-19-14-8-3-9-15-19)16-20(17-10-4-1-5-11-17)23-22(25)18-12-6-2-7-13-18/h1-16H,(H,23,25)/b20-16+
InChIKey WXRMWFIVPCXCPD-CAPFRKAQSA-N
Mol Weight 375.5 g/mol
Molecular Formula C22H17NOS2
Exact Mass 375.075157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAt0kfztBZN
Name 2-Propenethioic acid, 3-phenyl-3-[(phenylthioxomethyl)amino]-, S-phenyl ester
CAS Registry Number 83240-38-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17NOS2
InChI InChI=1S/C22H17NOS2/c24-21(26-19-14-8-3-9-15-19)16-20(17-10-4-1-5-11-17)23-22(25)18-12-6-2-7-13-18/h1-16H,(H,23,25)/b20-16+
InChIKey WXRMWFIVPCXCPD-CAPFRKAQSA-N
Molecular Weight 375.504 g/mol
SMILES N(\C(=C\C(Sc1ccccc1)=O)c1ccccc1)C(=S)c1ccccc1
SPLASH splash10-0ar0-3940000000-7a615eafe4733813e5ee
Source of Spectrum F-38-947-0
Synonyms S-phenyl (2E)-3-(benzothioylamino)-3-phenyl-2-propenethioate S-phenylester of .beta.-thiobenzoylamino-thiocinnamic acid
Wiley ID 1357243