CID 55255033

773098-78-5

Structural Information

Molecular Formula
C8H8N2O4
SMILES
C1CC1N2C=C(C(=O)NC2=O)C(=O)O
InChI
InChI=1S/C8H8N2O4/c11-6-5(7(12)13)3-10(4-1-2-4)8(14)9-6/h3-4H,1-2H2,(H,12,13)(H,9,11,14)
InChIKey
HPWNKQNZJDYTMW-UHFFFAOYSA-N
Compound name
1-cyclopropyl-2,4-dioxopyrimidine-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.0484 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.05568 142.7
[M+Na]+ 219.03762 155.9
[M+NH4]+ 214.08222 148.7
[M+K]+ 235.01156 153.6
[M-H]- 195.04112 149.1
[M+Na-2H]- 217.02307 149.8
[M]+ 196.04785 147.1
[M]- 196.04895 147.1
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.