CID 63926

4(3h)-quinazolinone, 2-(phenylmethoxy)-3-(2-pyridinyl)-

Structural Information

Molecular Formula
C20H15N3O2
SMILES
C1=CC=C(C=C1)COC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=N4
InChI
InChI=1S/C20H15N3O2/c24-19-16-10-4-5-11-17(16)22-20(23(19)18-12-6-7-13-21-18)25-14-15-8-2-1-3-9-15/h1-13H,14H2
InChIKey
IRWJHIVVYHHTKX-UHFFFAOYSA-N
Compound name
2-phenylmethoxy-3-pyridin-2-ylquinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.11642 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.12370 178.7
[M+Na]+ 352.10564 187.9
[M-H]- 328.10914 185.1
[M+NH4]+ 347.15024 188.4
[M+K]+ 368.07958 180.8
[M+H-H2O]+ 312.11368 166.1
[M+HCOO]- 374.11462 197.9
[M+CH3COO]- 388.13027 188.8
[M+Na-2H]- 350.09109 186.6
[M]+ 329.11587 179.9
[M]- 329.11697 179.9
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.