CID 2386010

2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetic acid

Structural Information

Molecular Formula
C7H10N2O4
SMILES
CC1(C(=O)N(C(=O)N1)CC(=O)O)C
InChI
InChI=1S/C7H10N2O4/c1-7(2)5(12)9(3-4(10)11)6(13)8-7/h3H2,1-2H3,(H,8,13)(H,10,11)
InChIKey
UEBZIQDINQDHFR-UHFFFAOYSA-N
Compound name
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

12
Patents

186.06406 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.071336 135.6
[M+Na]+ 209.053278 144.9
[M-H]- 185.056784 134.6
[M+NH4]+ 204.097883 155.4
[M+K]+ 225.027218 143.2
[M+H-H2O]+ 169.061320 131.1
[M+HCOO]- 231.062261 153.5
[M+CH3COO]- 245.077911 176.1
[M+Na-2H]- 207.038726 138.0
[M]+ 186.06351142 134.5
[M]- 186.06460858 134.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe