CID 53678135
N-methyl-1h-1,2,3-triazole-4-carboxamide
Structural Information
- Molecular Formula
- C4H6N4O
- SMILES
- CNC(=O)C1=NNN=C1
- InChI
- InChI=1S/C4H6N4O/c1-5-4(9)3-2-6-8-7-3/h2H,1H3,(H,5,9)(H,6,7,8)
- InChIKey
- XKWXXDHHANZKOP-UHFFFAOYSA-N
- Compound name
- N-methyl-2H-triazole-4-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 127.06144 | 123.5 |
[M+Na]+ | 149.04338 | 131.7 |
[M-H]- | 125.04688 | 122.1 |
[M+NH4]+ | 144.08798 | 142.2 |
[M+K]+ | 165.01732 | 130.4 |
[M+H-H2O]+ | 109.05142 | 115.8 |
[M+HCOO]- | 171.05236 | 145.4 |
[M+CH3COO]- | 185.06801 | 168.1 |
[M+Na-2H]- | 147.02883 | 130.5 |
[M]+ | 126.05361 | 121.1 |
[M]- | 126.05471 | 121.1 |