CID 135539638

3-[(e)-[(2-hydroxyphenyl)methylidene]amino]-2-phenyl-3,4-dihydroquinazolin-4-one

Structural Information

Molecular Formula
C21H15N3O2
SMILES
C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2/N=C/C4=CC=CC=C4O
InChI
InChI=1S/C21H15N3O2/c25-19-13-7-4-10-16(19)14-22-24-20(15-8-2-1-3-9-15)23-18-12-6-5-11-17(18)21(24)26/h1-14,25H/b22-14+
InChIKey
MQMJSASATWYVEJ-HYARGMPZSA-N
Compound name
3-[(E)-(2-hydroxyphenyl)methylideneamino]-2-phenylquinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

341.11642 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.12370 181.2
[M+Na]+ 364.10564 190.4
[M-H]- 340.10914 189.4
[M+NH4]+ 359.15024 191.9
[M+K]+ 380.07958 183.1
[M+H-H2O]+ 324.11368 169.4
[M+HCOO]- 386.11462 202.8
[M+CH3COO]- 400.13027 191.6
[M+Na-2H]- 362.09109 188.6
[M]+ 341.11587 181.5
[M]- 341.11697 181.5
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.