CID 93228

Fluoroimide

Structural Information

Molecular Formula

C₁₀H₄Cl₂FNO₂

SMILES

C1=CC(=CC=C1N2C(=O)C(=C(C2=O)Cl)Cl)F

InChI

InChI=1S/C10H4Cl2FNO2/c11-7-8(12)10(16)14(9(7)15)6-3-1-5(13)2-4-6/h1-4H

InChIKey

IPENDKRRWFURRE-UHFFFAOYSA-N

Compound name

3,4-dichloro-1-(4-fluorophenyl)pyrrole-2,5-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 18658
Patents: 258.96033 Da
Monoisotopic Mass: 2.8
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]+	259.96761	147.7
[M+Na]+	281.94955	161.1
[M-H]-	257.95305	152.4
[M+NH4]+	276.99415	167.0
[M+K]+	297.92349	154.8
[M+H-H2O]+	241.95759	141.7
[M+HCOO]-	303.95853	161.3
[M+CH3COO]-	317.97418	192.1
[M+Na-2H]-	279.93500	149.1
[M]+	258.95978	150.6
[M]-	258.96088	150.6

Literature stripe

literature stripe

Patent stripe

patents stripe