CID 2751722

5-((4-chlorophenyl)methylene)-3-methyl-2,4-imidazolidinedione

Structural Information

Molecular Formula
C11H9ClN2O2
SMILES
CN1C(=O)/C(=C/C2=CC=C(C=C2)Cl)/NC1=O
InChI
InChI=1S/C11H9ClN2O2/c1-14-10(15)9(13-11(14)16)6-7-2-4-8(12)5-3-7/h2-6H,1H3,(H,13,16)/b9-6-
InChIKey
RKXCUDAPOQQJHP-TWGQIWQCSA-N
Compound name
(5Z)-5-[(4-chlorophenyl)methylidene]-3-methylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

236.03525 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.04253 150.3
[M+Na]+ 259.02447 160.9
[M-H]- 235.02797 153.5
[M+NH4]+ 254.06907 167.7
[M+K]+ 274.99841 154.7
[M+H-H2O]+ 219.03251 143.6
[M+HCOO]- 281.03345 165.7
[M+CH3COO]- 295.04910 185.8
[M+Na-2H]- 257.00992 151.4
[M]+ 236.03470 149.5
[M]- 236.03580 149.5
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