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

*Links on SpectraBase are not permalinks.

2-Methyl-4,6-dinitrobenzamide

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

2-Methyl-4,6-dinitrobenzamide
SpectraBase Compound ID BtExDI1HPmk
InChI InChI=1S/C8H7N3O5/c1-4-2-5(10(13)14)3-6(11(15)16)7(4)8(9)12/h2-3H,1H3,(H2,9,12)
InChIKey YTUKZWSMRTXUPV-UHFFFAOYSA-N
Mol Weight 225.16 g/mol
Molecular Formula C8H7N3O5
Exact Mass 225.03857 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID INg0jY44Nyd
Name 2-Methyl-4,6-dinitrobenzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 225.038570332 u
Formula C8H7N3O5
InChI InChI=1S/C8H7N3O5/c1-4-2-5(10(13)14)3-6(11(15)16)7(4)8(9)12/h2-3H,1H3,(H2,9,12)
InChIKey YTUKZWSMRTXUPV-UHFFFAOYSA-N
Molecular Weight 225.160 g/mol
SMILES C1(=C(C(C)=CC(N(=O)=O)=C1)C(=O)N)N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930676