For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzenecarbothioamide, 2-nitro-N-(phenylmethyl)-
SpectraBase Compound ID HEmvUkfPLts
InChI InChI=1S/C14H12N2O2S/c17-16(18)13-9-5-4-8-12(13)14(19)15-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,15,19)
InChIKey ZKBBQRDCDDTYNU-UHFFFAOYSA-N
Mol Weight 272.32 g/mol
Molecular Formula C14H12N2O2S
Exact Mass 272.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2kuC7FI3N1i
Name Benzenecarbothioamide, 2-nitro-N-(phenylmethyl)-
CAS Registry Number 87866-37-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N2O2S
InChI InChI=1S/C14H12N2O2S/c17-16(18)13-9-5-4-8-12(13)14(19)15-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,15,19)
InChIKey ZKBBQRDCDDTYNU-UHFFFAOYSA-N
Molecular Weight 272.322 g/mol
SMILES N(C(c1c(N(=O)=O)cccc1)=S)Cc1ccccc1
SPLASH splash10-0uk9-0900000000-35461d5b04883a768f95
Source of Spectrum O-18-163-1
Synonyms N-Benzyl-2-nitro-thiobenzamide N-benzyl-2-nitrobenzenecarbothioamide N-phenylmethyl-2-nitrobenzenecarbothioamide
Wiley ID 1275948