CID 22947

6440-58-0

Structural Information

Molecular Formula
C7H12N2O4
SMILES
CC1(C(=O)N(C(=O)N1CO)CO)C
InChI
InChI=1S/C7H12N2O4/c1-7(2)5(12)8(3-10)6(13)9(7)4-11/h10-11H,3-4H2,1-2H3
InChIKey
WSDISUOETYTPRL-UHFFFAOYSA-N
Compound name
1,3-bis(hydroxymethyl)-5,5-dimethylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
10
Annotation Hits

25
References

32477
Patents

188.07971 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.08699 136.0
[M+Na]+ 211.06893 146.2
[M-H]- 187.07243 135.2
[M+NH4]+ 206.11353 156.2
[M+K]+ 227.04287 144.5
[M+H-H2O]+ 171.07697 131.6
[M+HCOO]- 233.07791 154.7
[M+CH3COO]- 247.09356 177.3
[M+Na-2H]- 209.05438 138.9
[M]+ 188.07916 136.6
[M]- 188.08026 136.6
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.