CID 22986635

1,3-dimethyl-2-oxoimidazolidine-4-carboxylic acid

Structural Information

Molecular Formula
C6H10N2O3
SMILES
CN1CC(N(C1=O)C)C(=O)O
InChI
InChI=1S/C6H10N2O3/c1-7-3-4(5(9)10)8(2)6(7)11/h4H,3H2,1-2H3,(H,9,10)
InChIKey
WWEBUHYSGAZECX-UHFFFAOYSA-N
Compound name
1,3-dimethyl-2-oxoimidazolidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

158.06914 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.076416 131.0
[M+Na]+ 181.058358 140.0
[M-H]- 157.061864 131.1
[M+NH4]+ 176.102963 150.7
[M+K]+ 197.032298 139.2
[M+H-H2O]+ 141.066400 125.2
[M+HCOO]- 203.067341 150.2
[M+CH3COO]- 217.082991 174.6
[M+Na-2H]- 179.043806 132.7
[M]+ 158.06859142 130.2
[M]- 158.06968858 130.2
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