CID 460268

Win49356

Structural Information

Molecular Formula
C15H14N4O
SMILES
CCCN1C=CC(=O)C2=CN=C(N=C21)C3=CC=NC=C3
InChI
InChI=1S/C15H14N4O/c1-2-8-19-9-5-13(20)12-10-17-14(18-15(12)19)11-3-6-16-7-4-11/h3-7,9-10H,2,8H2,1H3
InChIKey
KXRRSWLNTNIUDD-UHFFFAOYSA-N
Compound name
8-propyl-2-pyridin-4-ylpyrido[2,3-d]pyrimidin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

266.11676 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.124036 163.2
[M+Na]+ 289.105978 173.9
[M-H]- 265.109484 165.6
[M+NH4]+ 284.150583 175.2
[M+K]+ 305.079918 167.5
[M+H-H2O]+ 249.114020 152.2
[M+HCOO]- 311.114961 181.7
[M+CH3COO]- 325.130611 174.3
[M+Na-2H]- 287.091426 171.5
[M]+ 266.11621142 164.9
[M]- 266.11730858 164.9
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

patents stripe