CID 71757528
1,5-diazabicyclo[3.2.2]nonane-6-carboxylic acid dihydrochloride
Structural Information
- Molecular Formula
- C8H14N2O2
- SMILES
- C1CN2CCN(C1)C(C2)C(=O)O
- InChI
- InChI=1S/C8H14N2O2/c11-8(12)7-6-9-2-1-3-10(7)5-4-9/h7H,1-6H2,(H,11,12)
- InChIKey
- CYTFKMLBBRZSLR-UHFFFAOYSA-N
- Compound name
- 1,5-diazabicyclo[3.2.2]nonane-6-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 171.11281 | 141.8 |
[M+Na]+ | 193.09475 | 149.6 |
[M-H]- | 169.09825 | 140.3 |
[M+NH4]+ | 188.13935 | 161.0 |
[M+K]+ | 209.06869 | 147.8 |
[M+H-H2O]+ | 153.10279 | 140.8 |
[M+HCOO]- | 215.10373 | 150.8 |
[M+CH3COO]- | 229.11938 | 151.3 |
[M+Na-2H]- | 191.08020 | 151.5 |
[M]+ | 170.10498 | 139.8 |
[M]- | 170.10608 | 139.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.