CID 58811
101711-02-8
Structural Information
- Molecular Formula
- C17H19NO3
- SMILES
- CC(C)C(C1=CC=CC=C1)(C(=O)OCC2=CC=CC=N2)O
- InChI
- InChI=1S/C17H19NO3/c1-13(2)17(20,14-8-4-3-5-9-14)16(19)21-12-15-10-6-7-11-18-15/h3-11,13,20H,12H2,1-2H3
- InChIKey
- FLUMCGBIBFGWKF-UHFFFAOYSA-N
- Compound name
- pyridin-2-ylmethyl 2-hydroxy-3-methyl-2-phenylbutanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 286.14378 | 167.1 |
[M+Na]+ | 308.12572 | 179.3 |
[M+NH4]+ | 303.17032 | 173.6 |
[M+K]+ | 324.09966 | 173.8 |
[M-H]- | 284.12922 | 169.0 |
[M+Na-2H]- | 306.11117 | 174.8 |
[M]+ | 285.13595 | 169.3 |
[M]- | 285.13705 | 169.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.