CID 3053636

70203-75-7

Structural Information

Molecular Formula
C19H19N3O2
SMILES
CC(C)C(C(=O)N)N1C(=NC2=CC=CC=C2C1=O)C3=CC=CC=C3
InChI
InChI=1S/C19H19N3O2/c1-12(2)16(17(20)23)22-18(13-8-4-3-5-9-13)21-15-11-7-6-10-14(15)19(22)24/h3-12,16H,1-2H3,(H2,20,23)
InChIKey
RGAUPAALROCGOV-UHFFFAOYSA-N
Compound name
3-methyl-2-(4-oxo-2-phenylquinazolin-3-yl)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.14774 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.15502 175.1
[M+Na]+ 344.13696 189.2
[M+NH4]+ 339.18156 181.8
[M+K]+ 360.11090 182.8
[M-H]- 320.14046 178.8
[M+Na-2H]- 342.12241 182.5
[M]+ 321.14719 178.1
[M]- 321.14829 178.1
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.