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5-NITRO-1-METHYL-BENZOTRIAZOLE

View entire compound with spectra: 2 NMR, and 1 MS (GC)

5-NITRO-1-METHYL-BENZOTRIAZOLE
SpectraBase Compound ID GapVD3kRCpm
InChI InChI=1S/C7H6N4O2/c1-10-7-3-2-5(11(12)13)4-6(7)8-9-10/h2-4H,1H3
InChIKey BQPFSSQRLBUMQC-UHFFFAOYSA-N
Mol Weight 178.15 g/mol
Molecular Formula C7H6N4O2
Exact Mass 178.049075 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7vamGsrmGo
Name 5-NITRO-1-METHYL-BENZOTRIAZOLE
Compound Number 2B
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H6N4O2
InChI InChI=1S/C7H6N4O2/c1-10-7-3-2-5(11(12)13)4-6(7)8-9-10/h2-4H,1H3
InChIKey BQPFSSQRLBUMQC-UHFFFAOYSA-N
Literature Reference Author L.I.LARINA,V.MILATA
Literature Reference Citation MAGN.RES.CHEM.,47,142(2009)
Literature Reference DOI 10.1002/mrc.2366
Molecular Weight 178.150 g/mol
Solvent DMSO-D6
Source File Reference UWLU79403