CID 16102869
6-chloro-1-isopropyl-3-methylpyrimidine-2,4(1h,3h)-dione
Structural Information
- Molecular Formula
- C8H11ClN2O2
- SMILES
- CC(C)N1C(=CC(=O)N(C1=O)C)Cl
- InChI
- InChI=1S/C8H11ClN2O2/c1-5(2)11-6(9)4-7(12)10(3)8(11)13/h4-5H,1-3H3
- InChIKey
- CXSZWSOPYFTMGO-UHFFFAOYSA-N
- Compound name
- 6-chloro-3-methyl-1-propan-2-ylpyrimidine-2,4-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 203.05818 | 135.7 |
[M+Na]+ | 225.04012 | 148.3 |
[M-H]- | 201.04362 | 137.8 |
[M+NH4]+ | 220.08472 | 154.1 |
[M+K]+ | 241.01406 | 144.8 |
[M+H-H2O]+ | 185.04816 | 130.0 |
[M+HCOO]- | 247.04910 | 153.2 |
[M+CH3COO]- | 261.06475 | 185.5 |
[M+Na-2H]- | 223.02557 | 140.1 |
[M]+ | 202.05035 | 140.5 |
[M]- | 202.05145 | 140.5 |
Literature stripe
No literature data available for this compound.