CID 73012381

Allo-1

Structural Information

Molecular Formula
C17H15ClN2O2
SMILES
CC1C(=O)N(C(=O)N1CC2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C17H15ClN2O2/c1-12-16(21)20(15-9-7-14(18)8-10-15)17(22)19(12)11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3
InChIKey
GHAJNZREWTZYQJ-UHFFFAOYSA-N
Compound name
1-benzyl-3-(4-chlorophenyl)-5-methylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

314.0822 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.08948 171.9
[M+Na]+ 337.07142 187.7
[M+NH4]+ 332.11602 179.8
[M+K]+ 353.04536 181.0
[M-H]- 313.07492 176.6
[M+Na-2H]- 335.05687 180.1
[M]+ 314.08165 175.8
[M]- 314.08275 175.8
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

No patent data available for this compound.