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

*Links on SpectraBase are not permalinks.

4-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoic acid

Compound with spectra: 1 NMR, and 1 MS (GC)

4-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoic acid
SpectraBase Compound ID 7G0LymdrepU
InChI InChI=1S/C17H14N4O4S/c1-20-15(9-11-5-3-2-4-6-11)18-19-17(20)26-14-8-7-12(16(22)23)10-13(14)21(24)25/h2-8,10H,9H2,1H3,(H,22,23)
InChIKey CMLPATXOTMEUPX-UHFFFAOYSA-N
Mol Weight 370.38 g/mol
Molecular Formula C17H14N4O4S
Exact Mass 370.073576 g/mol

View Spectrum of 4-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoic acid

1H NMR Spectrum
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

View Spectrum of 4-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoic acid

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
  • 4-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-benzoic acid
benzoic acid, 3-nitro-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-, methyl ester
3-Benzyl-1,2,4-triazolo[3,4-b]1,3(4H)-benzothiazine
4H-1,2,4-triazole, 3-[4-(1,1-dimethylethyl)phenyl]-4-methyl-5-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-
benzoic acid, 4-fluoro-, 2-[(E)-[4-(2-benzothiazolylthio)-3-nitrophenyl]methylidene]hydrazide
benzoic acid, 4-(2-benzothiazolylthio)-3,5-dinitro-
5-(2-nitrophenyl)-3-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-1H-1,2,4-triazole
Methyl 2-({2-[(4,5-dibenzyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzenecarboxylate
ethanone, 2-[[4-ethyl-5-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-
4-(1-hydroxy-1-phenylethyl)-3-nitrobenzoic acid ethyl ester
3-Methyl-5H-[1,2,4]triazolo[3,4-b][1,3]benzothiazin-5-one
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.