CID 24723812
4-(4-fluorophenyl)-4-oxobutanenitrile
Structural Information
- Molecular Formula
- C10H8FNO
- SMILES
- C1=CC(=CC=C1C(=O)CCC#N)F
- InChI
- InChI=1S/C10H8FNO/c11-9-5-3-8(4-6-9)10(13)2-1-7-12/h3-6H,1-2H2
- InChIKey
- QHHXFEHPLSKVCH-UHFFFAOYSA-N
- Compound name
- 4-(4-fluorophenyl)-4-oxobutanenitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 178.06627 | 139.2 |
[M+Na]+ | 200.04821 | 151.0 |
[M+NH4]+ | 195.09281 | 143.5 |
[M+K]+ | 216.02215 | 141.2 |
[M-H]- | 176.05171 | 132.4 |
[M+Na-2H]- | 198.03366 | 142.8 |
[M]+ | 177.05844 | 138.0 |
[M]- | 177.05954 | 138.0 |
Literature stripe
Patent stripe
No patent data available for this compound.