CID 135402057
Noc-5
Structural Information
- Molecular Formula
- C6H16N4O2
- SMILES
- CC(C)N(CCCN)/[N+](=N/O)/[O-]
- InChI
- InChI=1S/C6H16N4O2/c1-6(2)9(5-3-4-7)10(12)8-11/h6,11H,3-5,7H2,1-2H3/b10-8-
- InChIKey
- MTIRIKBRVALRPJ-NTMALXAHSA-N
- Compound name
- (Z)-[3-aminopropyl(propan-2-yl)amino]-hydroxyimino-oxidoazanium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 177.13460 | 137.3 |
[M+Na]+ | 199.11654 | 141.0 |
[M-H]- | 175.12004 | 138.2 |
[M+NH4]+ | 194.16114 | 156.0 |
[M+K]+ | 215.09048 | 138.4 |
[M+H-H2O]+ | 159.12458 | 135.5 |
[M+HCOO]- | 221.12552 | 164.2 |
[M+CH3COO]- | 235.14117 | 185.6 |
[M+Na-2H]- | 197.10199 | 142.8 |
[M]+ | 176.12677 | 134.4 |
[M]- | 176.12787 | 134.4 |