CID 12450869
69491-42-5
Structural Information
- Molecular Formula
- C7H12N2O2
- SMILES
- C1CN2CCN1CC2C(=O)O
- InChI
- InChI=1S/C7H12N2O2/c10-7(11)6-5-8-1-3-9(6)4-2-8/h6H,1-5H2,(H,10,11)
- InChIKey
- IUCABINPROMHPV-UHFFFAOYSA-N
- Compound name
- 1,4-diazabicyclo[2.2.2]octane-2-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 157.09715 | 129.6 |
[M+Na]+ | 179.07909 | 138.7 |
[M+NH4]+ | 174.12369 | 138.9 |
[M+K]+ | 195.05303 | 133.6 |
[M-H]- | 155.08259 | 125.6 |
[M+Na-2H]- | 177.06454 | 126.8 |
[M]+ | 156.08932 | 129.4 |
[M]- | 156.09042 | 129.4 |