CID 63457

Brn 0838184

Structural Information

Molecular Formula
C22H17N3O2
SMILES
CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)N=CC4=CC=CC=C4O
InChI
InChI=1S/C22H17N3O2/c1-15-24-20-8-4-3-7-19(20)22(27)25(15)18-12-10-17(11-13-18)23-14-16-6-2-5-9-21(16)26/h2-14,26H,1H3
InChIKey
OTJALLCHPRJMFT-UHFFFAOYSA-N
Compound name
3-[4-[(2-hydroxyphenyl)methylideneamino]phenyl]-2-methylquinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.13208 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.13936 186.6
[M+Na]+ 378.12130 196.3
[M-H]- 354.12480 195.0
[M+NH4]+ 373.16590 197.0
[M+K]+ 394.09524 188.8
[M+H-H2O]+ 338.12934 174.7
[M+HCOO]- 400.13028 207.8
[M+CH3COO]- 414.14593 196.9
[M+Na-2H]- 376.10675 192.6
[M]+ 355.13153 187.6
[M]- 355.13263 187.6
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.