CID 205651
18430-29-0
Structural Information
- Molecular Formula
- C6H12N3O
- SMILES
- CCC(C)[N+]1=NOC(=C1)N
- InChI
- InChI=1S/C6H12N3O/c1-3-5(2)9-4-6(7)10-8-9/h4-5H,3,7H2,1-2H3/q+1
- InChIKey
- YPENFIANZQHSDW-UHFFFAOYSA-N
- Compound name
- 3-butan-2-yloxadiazol-3-ium-5-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 143.10532 | 128.3 |
[M+Na]+ | 165.08726 | 136.7 |
[M-H]- | 141.09076 | 130.1 |
[M+NH4]+ | 160.13186 | 147.1 |
[M+K]+ | 181.06120 | 131.6 |
[M+H-H2O]+ | 125.09530 | 124.1 |
[M+HCOO]- | 187.09624 | 150.4 |
[M+CH3COO]- | 201.11189 | 169.0 |
[M+Na-2H]- | 163.07271 | 136.5 |
[M]+ | 142.09749 | 127.4 |
[M]- | 142.09859 | 127.4 |
Literature stripe
No literature data available for this compound.