CID 21706455

3,3-dimethyl-2-(2-oxoimidazolidin-1-yl)butanoic acid

Structural Information

Molecular Formula
C9H16N2O3
SMILES
CC(C)(C)C(C(=O)O)N1CCNC1=O
InChI
InChI=1S/C9H16N2O3/c1-9(2,3)6(7(12)13)11-5-4-10-8(11)14/h6H,4-5H2,1-3H3,(H,10,14)(H,12,13)
InChIKey
JCZGIFHVKPGICG-UHFFFAOYSA-N
Compound name
3,3-dimethyl-2-(2-oxoimidazolidin-1-yl)butanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

200.11609 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.12337 145.8
[M+Na]+ 223.10531 152.2
[M+NH4]+ 218.14991 150.4
[M+K]+ 239.07925 152.5
[M-H]- 199.10881 142.0
[M+Na-2H]- 221.09076 146.0
[M]+ 200.11554 145.0
[M]- 200.11664 145.0
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