CID 300572

Mls002702066

Structural Information

Molecular Formula
C21H18N2O2
SMILES
C1=CC=C(C=C1)COC2=CC=CC(=C2)C3NC4=CC=CC=C4C(=O)N3
InChI
InChI=1S/C21H18N2O2/c24-21-18-11-4-5-12-19(18)22-20(23-21)16-9-6-10-17(13-16)25-14-15-7-2-1-3-8-15/h1-13,20,22H,14H2,(H,23,24)
InChIKey
UFQXXOKTNXKMSO-UHFFFAOYSA-N
Compound name
2-(3-phenylmethoxyphenyl)-2,3-dihydro-1H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

330.13684 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.14412 180.8
[M+Na]+ 353.12606 197.1
[M+NH4]+ 348.17066 188.8
[M+K]+ 369.10000 187.6
[M-H]- 329.12956 186.6
[M+Na-2H]- 351.11151 190.5
[M]+ 330.13629 184.9
[M]- 330.13739 184.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.