CID 853684

2875-13-0

Structural Information

Molecular Formula

C₇H₆F₄N₂

SMILES

CN(C)C1=C(C(=NC(=C1F)F)F)F

InChI

InChI=1S/C7H6F4N2/c1-13(2)5-3(8)6(10)12-7(11)4(5)9/h1-2H3

InChIKey

UAGGKULAFQBSPP-UHFFFAOYSA-N

Compound name

2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 30
Patents: 194.0467 Da
Monoisotopic Mass: 2.0
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]+	195.05398	144.0
[M+Na]+	217.03592	153.1
[M+NH4]+	212.08052	149.0
[M+K]+	233.00986	148.0
[M-H]-	193.03942	140.9
[M+Na-2H]-	215.02137	147.6
[M]+	194.04615	144.1
[M]-	194.04725	144.1

Literature stripe

literature stripe

Patent stripe

patents stripe