CID 819992
2-(chloromethyl)-4-methoxy-3,5-dimethylpyridine
Structural Information
- Molecular Formula
- C9H12ClNO
- SMILES
- CC1=CN=C(C(=C1OC)C)CCl
- InChI
- InChI=1S/C9H12ClNO/c1-6-5-11-8(4-10)7(2)9(6)12-3/h5H,4H2,1-3H3
- InChIKey
- SRKVJDYNPSMHJM-UHFFFAOYSA-N
- Compound name
- 2-(chloromethyl)-4-methoxy-3,5-dimethylpyridine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 186.06803 | 136.2 |
[M+Na]+ | 208.04997 | 151.5 |
[M+NH4]+ | 203.09457 | 145.3 |
[M+K]+ | 224.02391 | 143.9 |
[M-H]- | 184.05347 | 138.5 |
[M+Na-2H]- | 206.03542 | 143.6 |
[M]+ | 185.06020 | 139.4 |
[M]- | 185.06130 | 139.4 |