CID 137698910

1702999-61-8

Structural Information

Molecular Formula
C10H13N3O3
SMILES
CC1=CN=C(N=C1C(=O)O)N2CCOCC2
InChI
InChI=1S/C10H13N3O3/c1-7-6-11-10(12-8(7)9(14)15)13-2-4-16-5-3-13/h6H,2-5H2,1H3,(H,14,15)
InChIKey
IIXPYXUSPRWUAG-UHFFFAOYSA-N
Compound name
5-methyl-2-morpholin-4-ylpyrimidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.09569 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.10297 149.5
[M+Na]+ 246.08491 161.6
[M+NH4]+ 241.12951 155.5
[M+K]+ 262.05885 157.5
[M-H]- 222.08841 151.5
[M+Na-2H]- 244.07036 154.7
[M]+ 223.09514 151.5
[M]- 223.09624 151.5
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.