CID 22218817

4-(propan-2-yl)imidazolidin-2-one

Structural Information

Molecular Formula
C6H12N2O
SMILES
CC(C)C1CNC(=O)N1
InChI
InChI=1S/C6H12N2O/c1-4(2)5-3-7-6(9)8-5/h4-5H,3H2,1-2H3,(H2,7,8,9)
InChIKey
FFLVDROJJYOUPY-UHFFFAOYSA-N
Compound name
4-propan-2-ylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

128.09496 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.10224 129.1
[M+Na]+ 151.08418 135.8
[M-H]- 127.08768 127.0
[M+NH4]+ 146.12878 148.9
[M+K]+ 167.05812 133.8
[M+H-H2O]+ 111.09222 123.0
[M+HCOO]- 173.09316 146.2
[M+CH3COO]- 187.10881 166.3
[M+Na-2H]- 149.06963 131.4
[M]+ 128.09441 123.4
[M]- 128.09551 123.4
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