CID 127783

101204-88-0

Structural Information

Molecular Formula
C14H18N4O
SMILES
CC1=NC2=C(C=CC=N2)C(=O)N1CN3CCCCC3
InChI
InChI=1S/C14H18N4O/c1-11-16-13-12(6-5-7-15-13)14(19)18(11)10-17-8-3-2-4-9-17/h5-7H,2-4,8-10H2,1H3
InChIKey
FFPRFGHBNGDGOT-UHFFFAOYSA-N
Compound name
2-methyl-3-(piperidin-1-ylmethyl)pyrido[2,3-d]pyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

258.14807 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.15535 162.6
[M+Na]+ 281.13729 170.6
[M-H]- 257.14079 164.1
[M+NH4]+ 276.18189 174.7
[M+K]+ 297.11123 165.3
[M+H-H2O]+ 241.14533 151.5
[M+HCOO]- 303.14627 177.2
[M+CH3COO]- 317.16192 172.4
[M+Na-2H]- 279.12274 168.2
[M]+ 258.14752 159.8
[M]- 258.14862 159.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.