CID 3105425

58050-54-7

Structural Information

Molecular Formula

C₁₁H₇Cl₂NO₂

SMILES

C1=COC(=C1)C(=O)NC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C11H7Cl2NO2/c12-7-3-4-9(8(13)6-7)14-11(15)10-2-1-5-16-10/h1-6H,(H,14,15)

InChIKey

INHZUTJGFJFPRQ-UHFFFAOYSA-N

Compound name

N-(2,4-dichlorophenyl)furan-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 254.98538 Da
Monoisotopic Mass: 3.2
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]+	255.992656	153.7
[M+Na]+	277.974598	163.7
[M-H]-	253.978104	160.9
[M+NH4]+	273.019203	172.2
[M+K]+	293.948538	159.1
[M+H-H2O]+	237.982640	148.6
[M+HCOO]-	299.983581	169.6
[M+CH3COO]-	313.999231	191.8
[M+Na-2H]-	275.960046	157.8
[M]+	254.98483142	157.9
[M]-	254.98592858	157.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.