CID 67000

1-monomethylol-5,5-dimethylhydantoin

Structural Information

Molecular Formula
C6H10N2O3
SMILES
CC1(C(=O)NC(=O)N1CO)C
InChI
InChI=1S/C6H10N2O3/c1-6(2)4(10)7-5(11)8(6)3-9/h9H,3H2,1-2H3,(H,7,10,11)
InChIKey
SIQZJFKTROUNPI-UHFFFAOYSA-N
Compound name
1-(hydroxymethyl)-5,5-dimethylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

2
References

8342
Patents

158.06914 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.076416 130.1
[M+Na]+ 181.058358 139.9
[M-H]- 157.061864 129.0
[M+NH4]+ 176.102963 151.2
[M+K]+ 197.032298 137.9
[M+H-H2O]+ 141.066400 125.5
[M+HCOO]- 203.067341 148.8
[M+CH3COO]- 217.082991 170.8
[M+Na-2H]- 179.043806 133.9
[M]+ 158.06859142 128.4
[M]- 158.06968858 128.4
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