CID 66926291

1265634-73-8

Structural Information

Molecular Formula
C15H14ClN3O2
SMILES
COC1=CC=C(C=C1)CN2CC3=C(C=CN=C3NC2=O)Cl
InChI
InChI=1S/C15H14ClN3O2/c1-21-11-4-2-10(3-5-11)8-19-9-12-13(16)6-7-17-14(12)18-15(19)20/h2-7H,8-9H2,1H3,(H,17,18,20)
InChIKey
PYIJHTHRVRUNEB-UHFFFAOYSA-N
Compound name
5-chloro-3-[(4-methoxyphenyl)methyl]-1,4-dihydropyrido[2,3-d]pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

303.07745 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.08473 168.6
[M+Na]+ 326.06667 178.1
[M-H]- 302.07017 170.5
[M+NH4]+ 321.11127 180.7
[M+K]+ 342.04061 171.2
[M+H-H2O]+ 286.07471 159.0
[M+HCOO]- 348.07565 179.7
[M+CH3COO]- 362.09130 178.6
[M+Na-2H]- 324.05212 173.3
[M]+ 303.07690 169.2
[M]- 303.07800 169.2
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