CID 6435337

Brn 0819696

Structural Information

Molecular Formula
C17H13ClN2O2
SMILES
CC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=CC=C3Cl)/NC2=O
InChI
InChI=1S/C17H13ClN2O2/c1-11-6-8-13(9-7-11)20-16(21)15(19-17(20)22)10-12-4-2-3-5-14(12)18/h2-10H,1H3,(H,19,22)/b15-10-
InChIKey
KRFCZTGZIXPNBN-GDNBJRDFSA-N
Compound name
(5Z)-5-[(2-chlorophenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.06656 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.07384 171.8
[M+Na]+ 335.05578 187.2
[M+NH4]+ 330.10038 179.1
[M+K]+ 351.02972 180.7
[M-H]- 311.05928 175.8
[M+Na-2H]- 333.04123 179.3
[M]+ 312.06601 175.3
[M]- 312.06711 175.3
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.