CID 3063598

Brn 0531038

Structural Information

Molecular Formula
C14H20N4O
SMILES
CCN(CC)CCN1C(=NC2=C(C1=O)C=CC=N2)C
InChI
InChI=1S/C14H20N4O/c1-4-17(5-2)9-10-18-11(3)16-13-12(14(18)19)7-6-8-15-13/h6-8H,4-5,9-10H2,1-3H3
InChIKey
ZFKRNMFFVAIAJE-UHFFFAOYSA-N
Compound name
3-[2-(diethylamino)ethyl]-2-methylpyrido[2,3-d]pyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.1637 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.17098 162.1
[M+Na]+ 283.15292 171.2
[M-H]- 259.15642 164.1
[M+NH4]+ 278.19752 176.8
[M+K]+ 299.12686 167.8
[M+H-H2O]+ 243.16096 152.6
[M+HCOO]- 305.16190 182.7
[M+CH3COO]- 319.17755 205.0
[M+Na-2H]- 281.13837 168.5
[M]+ 260.16315 166.5
[M]- 260.16425 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

No patent data available for this compound.