CID 24903910

Ethyl 2-cyclopropyl-6-oxo-1,6-dihydropyrimidine-5-carboxylate

Structural Information

Molecular Formula
C10H12N2O3
SMILES
CCOC(=O)C1=CN=C(NC1=O)C2CC2
InChI
InChI=1S/C10H12N2O3/c1-2-15-10(14)7-5-11-8(6-3-4-6)12-9(7)13/h5-6H,2-4H2,1H3,(H,11,12,13)
InChIKey
DZSPYMMOWYDUES-UHFFFAOYSA-N
Compound name
ethyl 2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

208.0848 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.09208 149.7
[M+Na]+ 231.07402 160.2
[M-H]- 207.07752 153.6
[M+NH4]+ 226.11862 160.7
[M+K]+ 247.04796 155.8
[M+H-H2O]+ 191.08206 141.8
[M+HCOO]- 253.08300 170.3
[M+CH3COO]- 267.09865 185.9
[M+Na-2H]- 229.05947 154.1
[M]+ 208.08425 153.0
[M]- 208.08535 153.0
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