CID 135408507

Methyl 2-amino-6-hydroxypyrimidine-4-carboxylate

Structural Information

Molecular Formula
C6H7N3O3
SMILES
COC(=O)C1=CC(=O)NC(=N1)N
InChI
InChI=1S/C6H7N3O3/c1-12-5(11)3-2-4(10)9-6(7)8-3/h2H,1H3,(H3,7,8,9,10)
InChIKey
DRHLMNDFBCJNGA-UHFFFAOYSA-N
Compound name
methyl 2-amino-6-oxo-1H-pyrimidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

169.04874 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.05602 131.8
[M+Na]+ 192.03796 141.4
[M-H]- 168.04146 131.9
[M+NH4]+ 187.08256 148.6
[M+K]+ 208.01190 139.4
[M+H-H2O]+ 152.04600 124.9
[M+HCOO]- 214.04694 153.7
[M+CH3COO]- 228.06259 176.4
[M+Na-2H]- 190.02341 137.8
[M]+ 169.04819 131.0
[M]- 169.04929 131.0
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