CID 66545139

1-[(4-chlorophenyl)methyl]-5,5-dimethylimidazolidin-2-one

Structural Information

Molecular Formula
C12H15ClN2O
SMILES
CC1(CNC(=O)N1CC2=CC=C(C=C2)Cl)C
InChI
InChI=1S/C12H15ClN2O/c1-12(2)8-14-11(16)15(12)7-9-3-5-10(13)6-4-9/h3-6H,7-8H2,1-2H3,(H,14,16)
InChIKey
XUDCGBBALDNPIO-UHFFFAOYSA-N
Compound name
1-[(4-chlorophenyl)methyl]-5,5-dimethylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.0873 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.094576 151.9
[M+Na]+ 261.076518 161.5
[M-H]- 237.080024 154.8
[M+NH4]+ 256.121123 171.1
[M+K]+ 277.050458 155.9
[M+H-H2O]+ 221.084560 145.3
[M+HCOO]- 283.085501 166.5
[M+CH3COO]- 297.101151 187.3
[M+Na-2H]- 259.061966 154.4
[M]+ 238.08675142 151.3
[M]- 238.08784858 151.3
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.