CID 165716412
1-benzyl-6-(trifluoromethyl)piperidin-3-ol
Structural Information
- Molecular Formula
- C13H16F3NO
- SMILES
- C1CC(N(CC1O)CC2=CC=CC=C2)C(F)(F)F
- InChI
- InChI=1S/C13H16F3NO/c14-13(15,16)12-7-6-11(18)9-17(12)8-10-4-2-1-3-5-10/h1-5,11-12,18H,6-9H2
- InChIKey
- NVFBWNQLPAXQTC-UHFFFAOYSA-N
- Compound name
- 1-benzyl-6-(trifluoromethyl)piperidin-3-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 260.12568 | 157.5 |
[M+Na]+ | 282.10762 | 163.5 |
[M-H]- | 258.11112 | 156.8 |
[M+NH4]+ | 277.15222 | 172.1 |
[M+K]+ | 298.08156 | 159.0 |
[M+H-H2O]+ | 242.11566 | 147.5 |
[M+HCOO]- | 304.11660 | 170.4 |
[M+CH3COO]- | 318.13225 | 192.3 |
[M+Na-2H]- | 280.09307 | 159.9 |
[M]+ | 259.11785 | 148.7 |
[M]- | 259.11895 | 148.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.