CID 22733313
1-methanesulfonylpiperidine-4-carbonitrile
Structural Information
- Molecular Formula
- C7H12N2O2S
- SMILES
- CS(=O)(=O)N1CCC(CC1)C#N
- InChI
- InChI=1S/C7H12N2O2S/c1-12(10,11)9-4-2-7(6-8)3-5-9/h7H,2-5H2,1H3
- InChIKey
- LZPNPUNUFAYEIE-UHFFFAOYSA-N
- Compound name
- 1-methylsulfonylpiperidine-4-carbonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 189.06923 | 137.6 |
[M+Na]+ | 211.05117 | 146.9 |
[M+NH4]+ | 206.09577 | 141.7 |
[M+K]+ | 227.02511 | 137.9 |
[M-H]- | 187.05467 | 130.4 |
[M+Na-2H]- | 209.03662 | 139.0 |
[M]+ | 188.06140 | 136.3 |
[M]- | 188.06250 | 136.3 |
Literature stripe
No literature data available for this compound.