CID 1858356
(2z)-2-(nitromethylidene)azepane
Structural Information
- Molecular Formula
- C7H12N2O2
- SMILES
- C1CC/C(=C/[N+](=O)[O-])/NCC1
- InChI
- InChI=1S/C7H12N2O2/c10-9(11)6-7-4-2-1-3-5-8-7/h6,8H,1-5H2/b7-6-
- InChIKey
- VVTVZDUKYJWIDH-SREVYHEPSA-N
- Compound name
- (2Z)-2-(nitromethylidene)azepane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 157.09715 | 133.6 |
[M+Na]+ | 179.07909 | 142.0 |
[M+NH4]+ | 174.12369 | 140.4 |
[M+K]+ | 195.05303 | 140.6 |
[M-H]- | 155.08259 | 134.9 |
[M+Na-2H]- | 177.06454 | 137.6 |
[M]+ | 156.08932 | 134.8 |
[M]- | 156.09042 | 134.8 |
Literature stripe
Patent stripe
No patent data available for this compound.