CID 164369

134999-57-8

Structural Information

Molecular Formula
C15H12ClN3O
SMILES
C1=CC2=C(N=C1)N=CN=C2OCCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C15H12ClN3O/c16-12-5-3-11(4-6-12)7-9-20-15-13-2-1-8-17-14(13)18-10-19-15/h1-6,8,10H,7,9H2
InChIKey
WJVXGYIWHYIDPG-UHFFFAOYSA-N
Compound name
4-[2-(4-chlorophenyl)ethoxy]pyrido[2,3-d]pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

285.0669 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.07418 162.7
[M+Na]+ 308.05612 172.7
[M-H]- 284.05962 165.7
[M+NH4]+ 303.10072 175.9
[M+K]+ 324.03006 166.0
[M+H-H2O]+ 268.06416 152.3
[M+HCOO]- 330.06510 177.7
[M+CH3COO]- 344.08075 173.8
[M+Na-2H]- 306.04157 171.4
[M]+ 285.06635 166.3
[M]- 285.06745 166.3
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