CID 59340826
4''-(3-buten-1-yl)-2'-fluoro-4-methyl-1,1':4',1''-terphenyl
Structural Information
- Molecular Formula
- C23H21F
- SMILES
- CC1=CC=C(C=C1)C2=C(C=C(C=C2)C3=CC=C(C=C3)CCC=C)F
- InChI
- InChI=1S/C23H21F/c1-3-4-5-18-8-12-19(13-9-18)21-14-15-22(23(24)16-21)20-10-6-17(2)7-11-20/h3,6-16H,1,4-5H2,2H3
- InChIKey
- IPYFBFAHNQQYFX-UHFFFAOYSA-N
- Compound name
- 4-(4-but-3-enylphenyl)-2-fluoro-1-(4-methylphenyl)benzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 317.17000 | 176.6 |
[M+Na]+ | 339.15194 | 184.7 |
[M-H]- | 315.15544 | 184.9 |
[M+NH4]+ | 334.19654 | 191.0 |
[M+K]+ | 355.12588 | 177.0 |
[M+H-H2O]+ | 299.15998 | 166.4 |
[M+HCOO]- | 361.16092 | 198.2 |
[M+CH3COO]- | 375.17657 | 187.7 |
[M+Na-2H]- | 337.13739 | 178.5 |
[M]+ | 316.16217 | 175.7 |
[M]- | 316.16327 | 175.7 |
Literature stripe
No literature data available for this compound.