CID 76953
5-(3-methyltriazen-1-yl)imidazole-4-carboxamide
Structural Information
- Molecular Formula
- C5H8N6O
- SMILES
- CN=NNC1=C(NC=N1)C(=O)N
- InChI
- InChI=1S/C5H8N6O/c1-7-11-10-5-3(4(6)12)8-2-9-5/h2H,1H3,(H2,6,12)(H,7,10)(H,8,9)
- InChIKey
- MVBPAIHFZZKRGD-UHFFFAOYSA-N
- Compound name
- 4-(2-methyliminohydrazinyl)-1H-imidazole-5-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 169.08324 | 130.9 |
[M+Na]+ | 191.06518 | 138.0 |
[M-H]- | 167.06868 | 133.5 |
[M+NH4]+ | 186.10978 | 149.5 |
[M+K]+ | 207.03912 | 137.4 |
[M+H-H2O]+ | 151.07322 | 122.3 |
[M+HCOO]- | 213.07416 | 159.5 |
[M+CH3COO]- | 227.08981 | 188.4 |
[M+Na-2H]- | 189.05063 | 138.2 |
[M]+ | 168.07541 | 128.6 |
[M]- | 168.07651 | 128.6 |