CID 63148

4(3h)-quinazolinone, 3-(4-bromophenyl)-7-fluoro-2-methyl-

Structural Information

Molecular Formula
C15H10BrFN2O
SMILES
CC1=NC2=C(C=CC(=C2)F)C(=O)N1C3=CC=C(C=C3)Br
InChI
InChI=1S/C15H10BrFN2O/c1-9-18-14-8-11(17)4-7-13(14)15(20)19(9)12-5-2-10(16)3-6-12/h2-8H,1H3
InChIKey
RFUVXJVXRWWSEO-UHFFFAOYSA-N
Compound name
3-(4-bromophenyl)-7-fluoro-2-methylquinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.99606 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.00334 166.7
[M+Na]+ 354.98528 173.9
[M+NH4]+ 350.02988 171.2
[M+K]+ 370.95922 171.5
[M-H]- 330.98878 168.3
[M+Na-2H]- 352.97073 171.9
[M]+ 331.99551 167.2
[M]- 331.99661 167.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.