CID 297283
3-hydroxyquinuclidine-3-carbonitrile
Structural Information
- Molecular Formula
- C8H12N2O
- SMILES
- C1CN2CCC1C(C2)(C#N)O
- InChI
- InChI=1S/C8H12N2O/c9-5-8(11)6-10-3-1-7(8)2-4-10/h7,11H,1-4,6H2
- InChIKey
- BEDKJKABPPDZNB-UHFFFAOYSA-N
- Compound name
- 3-hydroxy-1-azabicyclo[2.2.2]octane-3-carbonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 153.10224 | 140.5 |
[M+Na]+ | 175.08418 | 149.8 |
[M+NH4]+ | 170.12878 | 148.3 |
[M+K]+ | 191.05812 | 138.5 |
[M-H]- | 151.08768 | 131.2 |
[M+Na-2H]- | 173.06963 | 137.6 |
[M]+ | 152.09441 | 138.4 |
[M]- | 152.09551 | 138.4 |