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

*Links on SpectraBase are not permalinks.

2,7-Dimethyl-3,5-dioxo-4,6(2H)-dihydro-1,2,4-triazepine

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

2,7-Dimethyl-3,5-dioxo-4,6(2H)-dihydro-1,2,4-triazepine
SpectraBase Compound ID BWfe56e5f8z
InChI InChI=1S/C6H9N3O2/c1-4-3-5(10)7-6(11)9(2)8-4/h3H2,1-2H3,(H,7,10,11)
InChIKey DMIJWYIWEMLDRD-UHFFFAOYSA-N
Mol Weight 155.16 g/mol
Molecular Formula C6H9N3O2
Exact Mass 155.069477 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID BCNPdgqxKoS
Name 2,7-Dimethyl-3,5-dioxo-4,6(2H)-dihydro-1,2,4-triazepine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 155.069476540 u
Formula C6H9N3O2
InChI InChI=1S/C6H9N3O2/c1-4-3-5(10)7-6(11)9(2)8-4/h3H2,1-2H3,(H,7,10,11)
InChIKey DMIJWYIWEMLDRD-UHFFFAOYSA-N
Molecular Weight 155.157 g/mol
SMILES C1(=NN(C(NC(C1)=O)=O)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.964159