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]+ 267.12404 163.2
[M+Na]+ 289.10598 173.9
[M-H]- 265.10948 165.6
[M+NH4]+ 284.15058 175.2
[M+K]+ 305.07992 167.5
[M+H-H2O]+ 249.11402 152.2
[M+HCOO]- 311.11496 181.7
[M+CH3COO]- 325.13061 174.3
[M+Na-2H]- 287.09143 171.5
[M]+ 266.11621 164.9
[M]- 266.11731 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

No patent data available for this compound.