CID 63244

Brn 0814209

Structural Information

Molecular Formula
C17H15FN2O
SMILES
CCC1=NC2=C(C=C(C=C2)F)C(=O)N1C3=CC=CC(=C3)C
InChI
InChI=1S/C17H15FN2O/c1-3-16-19-15-8-7-12(18)10-14(15)17(21)20(16)13-6-4-5-11(2)9-13/h4-10H,3H2,1-2H3
InChIKey
MGPULHSQTSJFFK-UHFFFAOYSA-N
Compound name
2-ethyl-6-fluoro-3-(3-methylphenyl)quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

282.11685 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.12413 166.1
[M+Na]+ 305.10607 183.3
[M+NH4]+ 300.15067 174.2
[M+K]+ 321.08001 174.1
[M-H]- 281.10957 169.6
[M+Na-2H]- 303.09152 174.8
[M]+ 282.11630 169.7
[M]- 282.11740 169.7
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

patents stripe