CID 72206657
2-(chloromethyl)-5-fluoropyrimidine
Structural Information
- Molecular Formula
- C5H4ClFN2
- SMILES
- C1=C(C=NC(=N1)CCl)F
- InChI
- InChI=1S/C5H4ClFN2/c6-1-5-8-2-4(7)3-9-5/h2-3H,1H2
- InChIKey
- JTZQALAWTLCKRX-UHFFFAOYSA-N
- Compound name
- 2-(chloromethyl)-5-fluoropyrimidine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 147.01198 | 121.4 |
[M+Na]+ | 168.99392 | 132.2 |
[M-H]- | 144.99742 | 121.1 |
[M+NH4]+ | 164.03852 | 141.1 |
[M+K]+ | 184.96786 | 128.8 |
[M+H-H2O]+ | 129.00196 | 114.4 |
[M+HCOO]- | 191.00290 | 138.9 |
[M+CH3COO]- | 205.01855 | 172.4 |
[M+Na-2H]- | 166.97937 | 130.2 |
[M]+ | 146.00415 | 121.9 |
[M]- | 146.00525 | 121.9 |
Literature stripe
No literature data available for this compound.