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Benzenecarbothioamide, N-methyl-2-nitro-
SpectraBase Compound ID IsHgd5YBP85
InChI InChI=1S/C8H8N2O2S/c1-9-8(13)6-4-2-3-5-7(6)10(11)12/h2-5H,1H3,(H,9,13)
InChIKey RMRXPEXLYRGWHO-UHFFFAOYSA-N
Mol Weight 196.22 g/mol
Molecular Formula C8H8N2O2S
Exact Mass 196.030649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VLuGetVxO6
Name Benzenecarbothioamide, N-methyl-2-nitro-
CAS Registry Number 70231-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N2O2S
InChI InChI=1S/C8H8N2O2S/c1-9-8(13)6-4-2-3-5-7(6)10(11)12/h2-5H,1H3,(H,9,13)
InChIKey RMRXPEXLYRGWHO-UHFFFAOYSA-N
Molecular Weight 196.224 g/mol
SMILES N(C(c1c(N(=O)=O)cccc1)=S)C
SPLASH splash10-054k-5900000000-55c808a8bc4b92f5a693
Source of Spectrum O-15-641-1
Synonyms N-methyl-2-nitrobenzenecarbothioamide N-Methyl-2-nitrothiobenzamide
Wiley ID 1192552