CID 28973205
4-chloro-2-(difluoromethyl)quinazoline
Structural Information
- Molecular Formula
- C9H5ClF2N2
- SMILES
- C1=CC=C2C(=C1)C(=NC(=N2)C(F)F)Cl
- InChI
- InChI=1S/C9H5ClF2N2/c10-7-5-3-1-2-4-6(5)13-9(14-7)8(11)12/h1-4,8H
- InChIKey
- LKIIDXBEGXVCHB-UHFFFAOYSA-N
- Compound name
- 4-chloro-2-(difluoromethyl)quinazoline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 215.01821 | 137.2 |
[M+Na]+ | 237.00015 | 148.6 |
[M-H]- | 213.00365 | 136.6 |
[M+NH4]+ | 232.04475 | 155.3 |
[M+K]+ | 252.97409 | 143.2 |
[M+H-H2O]+ | 197.00819 | 128.6 |
[M+HCOO]- | 259.00913 | 151.2 |
[M+CH3COO]- | 273.02478 | 149.9 |
[M+Na-2H]- | 234.98560 | 144.6 |
[M]+ | 214.01038 | 136.9 |
[M]- | 214.01148 | 136.9 |
Literature stripe
No literature data available for this compound.