CID 2591717

853318-99-7

Structural Information

Molecular Formula
C23H19N3O2
SMILES
C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)CN3C=NC4=CC=CC=C4C3=O
InChI
InChI=1S/C23H19N3O2/c27-22(15-26-16-24-21-13-7-5-11-19(21)23(26)28)25-20-12-6-4-10-18(20)14-17-8-2-1-3-9-17/h1-13,16H,14-15H2,(H,25,27)
InChIKey
ZCPFOLOWXRSGAA-UHFFFAOYSA-N
Compound name
N-(2-benzylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.14774 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.15502 189.0
[M+Na]+ 392.13696 196.0
[M-H]- 368.14046 196.5
[M+NH4]+ 387.18156 198.1
[M+K]+ 408.11090 188.8
[M+H-H2O]+ 352.14500 176.8
[M+HCOO]- 414.14594 208.9
[M+CH3COO]- 428.16159 198.1
[M+Na-2H]- 390.12241 195.0
[M]+ 369.14719 188.9
[M]- 369.14829 188.9
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.