CID 2751722

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

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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	237.042526	150.3
[M+Na]+	259.024468	160.9
[M-H]-	235.027974	153.5
[M+NH4]+	254.069073	167.7
[M+K]+	274.998408	154.7
[M+H-H2O]+	219.032510	143.6
[M+HCOO]-	281.033451	165.7
[M+CH3COO]-	295.049101	185.8
[M+Na-2H]-	257.009916	151.4
[M]+	236.03470142	149.5
[M]-	236.03579858	149.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe