CID 2737505
405-64-1
Structural Information
- Molecular Formula
- C9H11F
- SMILES
- CCCC1=CC=C(C=C1)F
- InChI
- InChI=1S/C9H11F/c1-2-3-8-4-6-9(10)7-5-8/h4-7H,2-3H2,1H3
- InChIKey
- LUJGLFMPEZIRRP-UHFFFAOYSA-N
- Compound name
- 1-fluoro-4-propylbenzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 139.09175 | 125.4 |
[M+Na]+ | 161.07369 | 133.9 |
[M-H]- | 137.07719 | 128.0 |
[M+NH4]+ | 156.11829 | 147.5 |
[M+K]+ | 177.04763 | 131.7 |
[M+H-H2O]+ | 121.08173 | 119.4 |
[M+HCOO]- | 183.08267 | 149.0 |
[M+CH3COO]- | 197.09832 | 175.3 |
[M+Na-2H]- | 159.05914 | 132.6 |
[M]+ | 138.08392 | 124.6 |
[M]- | 138.08502 | 124.6 |