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]+ 261.170976 162.1
[M+Na]+ 283.152918 171.2
[M-H]- 259.156424 164.1
[M+NH4]+ 278.197523 176.8
[M+K]+ 299.126858 167.8
[M+H-H2O]+ 243.160960 152.6
[M+HCOO]- 305.161901 182.7
[M+CH3COO]- 319.177551 205.0
[M+Na-2H]- 281.138366 168.5
[M]+ 260.16315142 166.5
[M]- 260.16424858 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.