CID 19020076
127523-43-7
Structural Information
- Molecular Formula
- C22H18FN
- SMILES
- CCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC=C(C=C3)C#N)F
- InChI
- InChI=1S/C22H18FN/c1-2-3-16-4-8-18(9-5-16)20-12-13-21(22(23)14-20)19-10-6-17(15-24)7-11-19/h4-14H,2-3H2,1H3
- InChIKey
- CCRAFIJEOWNROF-UHFFFAOYSA-N
- Compound name
- 4-[2-fluoro-4-(4-propylphenyl)phenyl]benzonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 316.14961 | 179.3 |
[M+Na]+ | 338.13155 | 190.2 |
[M-H]- | 314.13505 | 185.6 |
[M+NH4]+ | 333.17615 | 192.1 |
[M+K]+ | 354.10549 | 180.6 |
[M+H-H2O]+ | 298.13959 | 163.2 |
[M+HCOO]- | 360.14053 | 197.4 |
[M+CH3COO]- | 374.15618 | 188.8 |
[M+Na-2H]- | 336.11700 | 180.9 |
[M]+ | 315.14178 | 173.4 |
[M]- | 315.14288 | 173.4 |
Literature stripe
No literature data available for this compound.