CID 63468

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

Structural Information

Molecular Formula
C16H13FN2O2
SMILES
CC1=NC2=C(C=C(C=C2)F)C(=O)N1C3=CC=CC=C3OC
InChI
InChI=1S/C16H13FN2O2/c1-10-18-13-8-7-11(17)9-12(13)16(20)19(10)14-5-3-4-6-15(14)21-2/h3-9H,1-2H3
InChIKey
ANDCPRWZVCFJDY-UHFFFAOYSA-N
Compound name
6-fluoro-3-(2-methoxyphenyl)-2-methylquinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.0961 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.103376 163.8
[M+Na]+ 307.085318 175.7
[M-H]- 283.088824 168.5
[M+NH4]+ 302.129923 178.4
[M+K]+ 323.059258 170.2
[M+H-H2O]+ 267.093360 153.5
[M+HCOO]- 329.094301 183.9
[M+CH3COO]- 343.109951 176.1
[M+Na-2H]- 305.070766 169.5
[M]+ 284.09555142 166.2
[M]- 284.09664858 166.2
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.