CID 63246
Brn 0814095
Structural Information
- Molecular Formula
- C16H12ClFN2O
- SMILES
- CCC1=NC2=C(C=C(C=C2)F)C(=O)N1C3=CC=C(C=C3)Cl
- InChI
- InChI=1S/C16H12ClFN2O/c1-2-15-19-14-8-5-11(18)9-13(14)16(21)20(15)12-6-3-10(17)4-7-12/h3-9H,2H2,1H3
- InChIKey
- HKLNIKHEYDEMRD-UHFFFAOYSA-N
- Compound name
- 3-(4-chlorophenyl)-2-ethyl-6-fluoroquinazolin-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 303.06951 | 166.0 |
[M+Na]+ | 325.05145 | 178.8 |
[M-H]- | 301.05495 | 170.3 |
[M+NH4]+ | 320.09605 | 180.8 |
[M+K]+ | 341.02539 | 171.2 |
[M+H-H2O]+ | 285.05949 | 156.2 |
[M+HCOO]- | 347.06043 | 181.3 |
[M+CH3COO]- | 361.07608 | 178.0 |
[M+Na-2H]- | 323.03690 | 171.2 |
[M]+ | 302.06168 | 169.2 |
[M]- | 302.06278 | 169.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.