CID 63784

Brn 0823441

Structural Information

Molecular Formula
C17H15FN2O2
SMILES
CCC1=NC2=C(C=C(C=C2)F)C(=O)N1C3=CC=C(C=C3)OC
InChI
InChI=1S/C17H15FN2O2/c1-3-16-19-15-9-4-11(18)10-14(15)17(21)20(16)12-5-7-13(22-2)8-6-12/h4-10H,3H2,1-2H3
InChIKey
DZDRYKUWDCMWLD-UHFFFAOYSA-N
Compound name
2-ethyl-6-fluoro-3-(4-methoxyphenyl)quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.11176 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.11904 169.5
[M+Na]+ 321.10098 186.1
[M+NH4]+ 316.14558 176.9
[M+K]+ 337.07492 177.5
[M-H]- 297.10448 172.4
[M+Na-2H]- 319.08643 177.7
[M]+ 298.11121 172.8
[M]- 298.11231 172.8
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.