CID 117761086

1h,2h,3h-pyrido[1,2-c]pyrimidine-1,3-dione

Structural Information

Molecular Formula
C8H6N2O2
SMILES
C1=CC2=CC(=O)NC(=O)N2C=C1
InChI
InChI=1S/C8H6N2O2/c11-7-5-6-3-1-2-4-10(6)8(12)9-7/h1-5H,(H,9,11,12)
InChIKey
NMVFPAXKGOERKD-UHFFFAOYSA-N
Compound name
pyrido[1,2-c]pyrimidine-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

162.04292 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.05020 128.0
[M+Na]+ 185.03214 139.3
[M-H]- 161.03564 129.4
[M+NH4]+ 180.07674 146.7
[M+K]+ 201.00608 135.4
[M+H-H2O]+ 145.04018 121.2
[M+HCOO]- 207.04112 149.5
[M+CH3COO]- 221.05677 142.0
[M+Na-2H]- 183.01759 138.2
[M]+ 162.04237 127.8
[M]- 162.04347 127.8
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