CID 14998470

142557-61-7

Structural Information

Molecular Formula
C13H15N5O3
SMILES
CCN1C(=O)C2=CC(=C(N=C2N(C1=O)C3CC3)N)C(=O)N
InChI
InChI=1S/C13H15N5O3/c1-2-17-12(20)8-5-7(10(15)19)9(14)16-11(8)18(13(17)21)6-3-4-6/h5-6H,2-4H2,1H3,(H2,14,16)(H2,15,19)
InChIKey
HWODCHXORCTEGU-UHFFFAOYSA-N
Compound name
7-amino-1-cyclopropyl-3-ethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

19
References

17
Patents

289.1175 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.12478 175.0
[M+Na]+ 312.10672 187.9
[M-H]- 288.11022 179.7
[M+NH4]+ 307.15132 182.7
[M+K]+ 328.08066 180.5
[M+H-H2O]+ 272.11476 166.6
[M+HCOO]- 334.11570 195.1
[M+CH3COO]- 348.13135 211.2
[M+Na-2H]- 310.09217 177.1
[M]+ 289.11695 178.2
[M]- 289.11805 178.2
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

patents stripe