CID 2778952
496947-30-9
Structural Information
- Molecular Formula
- C18H14F3NO
- SMILES
- C1=CC=C2C(=C1)C=CC(=N2)CC(C3=CC=C(C=C3)C(F)(F)F)O
- InChI
- InChI=1S/C18H14F3NO/c19-18(20,21)14-8-5-13(6-9-14)17(23)11-15-10-7-12-3-1-2-4-16(12)22-15/h1-10,17,23H,11H2
- InChIKey
- TWXZARYDNLBGFM-UHFFFAOYSA-N
- Compound name
- 2-quinolin-2-yl-1-[4-(trifluoromethyl)phenyl]ethanol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 318.11003 | 171.8 |
[M+Na]+ | 340.09197 | 179.8 |
[M-H]- | 316.09547 | 172.7 |
[M+NH4]+ | 335.13657 | 184.9 |
[M+K]+ | 356.06591 | 173.2 |
[M+H-H2O]+ | 300.10001 | 160.8 |
[M+HCOO]- | 362.10095 | 186.0 |
[M+CH3COO]- | 376.11660 | 204.8 |
[M+Na-2H]- | 338.07742 | 176.6 |
[M]+ | 317.10220 | 167.4 |
[M]- | 317.10330 | 167.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.