CID 70701115
Methyl 5-bromo-6-methylpicolinate
Structural Information
- Molecular Formula
- C8H8BrNO2
- SMILES
- CC1=C(C=CC(=N1)C(=O)OC)Br
- InChI
- InChI=1S/C8H8BrNO2/c1-5-6(9)3-4-7(10-5)8(11)12-2/h3-4H,1-2H3
- InChIKey
- IZHGDXUQVBDEBG-UHFFFAOYSA-N
- Compound name
- methyl 5-bromo-6-methylpyridine-2-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 229.98113 | 138.2 |
[M+Na]+ | 251.96307 | 142.1 |
[M+NH4]+ | 247.00767 | 142.5 |
[M+K]+ | 267.93701 | 142.7 |
[M-H]- | 227.96657 | 138.0 |
[M+Na-2H]- | 249.94852 | 141.7 |
[M]+ | 228.97330 | 137.5 |
[M]- | 228.97440 | 137.5 |