CID 121207908
2-(3-oxocyclobutyl)acetonitrile
Structural Information
- Molecular Formula
- C6H7NO
- SMILES
- C1C(CC1=O)CC#N
- InChI
- InChI=1S/C6H7NO/c7-2-1-5-3-6(8)4-5/h5H,1,3-4H2
- InChIKey
- PZUCMMIBKLVHSP-UHFFFAOYSA-N
- Compound name
- 2-(3-oxocyclobutyl)acetonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 110.06004 | 122.8 |
[M+Na]+ | 132.04198 | 129.6 |
[M+NH4]+ | 127.08659 | 124.6 |
[M+K]+ | 148.01592 | 123.0 |
[M-H]- | 108.04549 | 114.7 |
[M+Na-2H]- | 130.02743 | 123.6 |
[M]+ | 109.05222 | 119.5 |
[M]- | 109.05331 | 119.5 |
Literature stripe
No literature data available for this compound.