CID 4252361

17723-15-8

Structural Information

Molecular Formula

C₆H₄Cl₂F₂N₂

SMILES

CNC1=C(C(=NC(=C1Cl)F)F)Cl

InChI

InChI=1S/C6H4Cl2F2N2/c1-11-4-2(7)5(9)12-6(10)3(4)8/h1H3,(H,11,12)

InChIKey

RALRHMDYHYIJLG-UHFFFAOYSA-N

Compound name

3,5-dichloro-2,6-difluoro-N-methylpyridin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 211.97195 Da
Monoisotopic Mass: 3.0
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]+	212.97923	133.8
[M+Na]+	234.96117	146.3
[M-H]-	210.96467	133.7
[M+NH4]+	230.00577	153.0
[M+K]+	250.93511	140.8
[M+H-H2O]+	194.96921	127.8
[M+HCOO]-	256.97015	147.1
[M+CH3COO]-	270.98580	188.3
[M+Na-2H]-	232.94662	138.7
[M]+	211.97140	134.5
[M]-	211.97250	134.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe