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

*Links on SpectraBase are not permalinks.
1H-Benzotriazole, 1-nitromethyl-
SpectraBase Compound ID 4A8E6E864rD
InChI InChI=1S/C7H6N4O2/c12-11(13)5-10-7-4-2-1-3-6(7)8-9-10/h1-4H,5H2
InChIKey GIDADMVFIVDWHS-UHFFFAOYSA-N
Mol Weight 178.15 g/mol
Molecular Formula C7H6N4O2
Exact Mass 178.049075 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 AiIxRkuvVdm
Name 1H-Benzotriazole, 1-nitromethyl-
Alternate Name(s) 1-(Nitromethyl)-1H-1,2,3-benzotriazole 1-(Nitromethyl)benzotriazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6N4O2
InChI InChI=1S/C7H6N4O2/c12-11(13)5-10-7-4-2-1-3-6(7)8-9-10/h1-4H,5H2
InChIKey GIDADMVFIVDWHS-UHFFFAOYSA-N
Molecular Weight 178.151 g/mol
SMILES c1ccc2[n](nnc2c1)CN(=O)=O
SPLASH splash10-0059-9300000000-b4ab506901e5068c8bc3
Source of Spectrum AD-0-2532-0
Wiley ID 1420063