CID 63784

4(3h)-quinazolinone, 2-ethyl-6-fluoro-3-(4-methoxyphenyl)-

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]+ 299.119036 168.5
[M+Na]+ 321.100978 179.9
[M-H]- 297.104484 172.9
[M+NH4]+ 316.145583 182.5
[M+K]+ 337.074918 174.2
[M+H-H2O]+ 281.109020 157.9
[M+HCOO]- 343.109961 188.2
[M+CH3COO]- 357.125611 180.3
[M+Na-2H]- 319.086426 173.6
[M]+ 298.11121142 171.2
[M]- 298.11230858 171.2
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.