CID 3017602

65407-49-0

Structural Information

Molecular Formula
C8H10N2O4
SMILES
CCOC(=O)C1=CN=C(NC1=O)OC
InChI
InChI=1S/C8H10N2O4/c1-3-14-7(12)5-4-9-8(13-2)10-6(5)11/h4H,3H2,1-2H3,(H,9,10,11)
InChIKey
RJPMHGXYDBJTGU-UHFFFAOYSA-N
Compound name
ethyl 2-methoxy-6-oxo-1H-pyrimidine-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

198.06406 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.071336 138.5
[M+Na]+ 221.053278 147.9
[M-H]- 197.056784 138.7
[M+NH4]+ 216.097883 154.7
[M+K]+ 237.027218 146.5
[M+H-H2O]+ 181.061320 131.4
[M+HCOO]- 243.062261 159.5
[M+CH3COO]- 257.077911 180.2
[M+Na-2H]- 219.038726 144.2
[M]+ 198.06351142 141.6
[M]- 198.06460858 141.6
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