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2-Nitro-N-phenylbenzenecarbothioamide
SpectraBase Compound ID FKOcLGwlfFk
InChI InChI=1S/C13H10N2O2S/c16-15(17)12-9-5-4-8-11(12)13(18)14-10-6-2-1-3-7-10/h1-9H,(H,14,18)
InChIKey CQSZSLOGBUBTKU-UHFFFAOYSA-N
Mol Weight 258.29 g/mol
Molecular Formula C13H10N2O2S
Exact Mass 258.046299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bW700j5D3r
Name 2-Nitro-N-phenylbenzenecarbothioamide
CAS Registry Number 87866-34-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N2O2S
InChI InChI=1S/C13H10N2O2S/c16-15(17)12-9-5-4-8-11(12)13(18)14-10-6-2-1-3-7-10/h1-9H,(H,14,18)
InChIKey CQSZSLOGBUBTKU-UHFFFAOYSA-N
Molecular Weight 258.295 g/mol
SMILES S\C(c1ccccc1N(=O)=O)=N/c1ccccc1
SPLASH splash10-03di-0590000000-e9597691c3a3ee4575ea
Source of Spectrum O-18-163-1
Synonyms 2-Nitro-N-phenyl-thiobenzamide N-Phenyl-2-nitro-thiobenzamide
Wiley ID 1261487