CID 10006

Hydantoin

Structural Information

Molecular Formula
C3H4N2O2
SMILES
C1C(=O)NC(=O)N1
InChI
InChI=1S/C3H4N2O2/c6-2-1-4-3(7)5-2/h1H2,(H2,4,5,6,7)
InChIKey
WJRBRSLFGCUECM-UHFFFAOYSA-N
Compound name
imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

3455
References

111625
Patents

100.027275 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.034551 116.8
[M+Na]+ 123.016493 125.2
[M-H]- 99.019999 115.1
[M+NH4]+ 118.061098 137.6
[M+K]+ 138.990433 123.3
[M+H-H2O]+ 83.024535 111.1
[M+HCOO]- 145.025476 136.3
[M+CH3COO]- 159.041126 157.5
[M+Na-2H]- 121.001941 121.9
[M]+ 100.02672642 111.4
[M]- 100.02782358 111.4
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