CID 62313063
2-(butan-2-yl)-4-chloro-6-methylpyrimidine
Structural Information
- Molecular Formula
- C9H13ClN2
- SMILES
- CCC(C)C1=NC(=CC(=N1)Cl)C
- InChI
- InChI=1S/C9H13ClN2/c1-4-6(2)9-11-7(3)5-8(10)12-9/h5-6H,4H2,1-3H3
- InChIKey
- AHLDBLRZNGKNRD-UHFFFAOYSA-N
- Compound name
- 2-butan-2-yl-4-chloro-6-methylpyrimidine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 185.08400 | 137.4 |
[M+Na]+ | 207.06594 | 147.3 |
[M-H]- | 183.06944 | 138.5 |
[M+NH4]+ | 202.11054 | 156.1 |
[M+K]+ | 223.03988 | 143.7 |
[M+H-H2O]+ | 167.07398 | 131.1 |
[M+HCOO]- | 229.07492 | 153.7 |
[M+CH3COO]- | 243.09057 | 183.7 |
[M+Na-2H]- | 205.05139 | 142.7 |
[M]+ | 184.07617 | 140.3 |
[M]- | 184.07727 | 140.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.