CID 63273

73283-38-2

Structural Information

Molecular Formula
C16H13N3O2
SMILES
CN1C(=NC2=CC=CC=C2C1=O)CC(=O)C3=CN=CC=C3
InChI
InChI=1S/C16H13N3O2/c1-19-15(9-14(20)11-5-4-8-17-10-11)18-13-7-3-2-6-12(13)16(19)21/h2-8,10H,9H2,1H3
InChIKey
CTGBEQHKJDQHST-UHFFFAOYSA-N
Compound name
3-methyl-2-(2-oxo-2-pyridin-3-ylethyl)quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

279.10077 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.10805 163.1
[M+Na]+ 302.08999 179.9
[M+NH4]+ 297.13459 170.4
[M+K]+ 318.06393 172.1
[M-H]- 278.09349 166.3
[M+Na-2H]- 300.07544 172.2
[M]+ 279.10022 166.5
[M]- 279.10132 166.5
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

patents stripe