CID 22027364

1-(3,5-dichloropyridin-2-yl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula

C₇H₈Cl₂N₂

SMILES

CC(C1=C(C=C(C=N1)Cl)Cl)N

InChI

InChI=1S/C7H8Cl2N2/c1-4(10)7-6(9)2-5(8)3-11-7/h2-4H,10H2,1H3

InChIKey

IEIMANXIFJWWFP-UHFFFAOYSA-N

Compound name

1-(3,5-dichloropyridin-2-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 190.00645 Da
Monoisotopic Mass: 1.4
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]+	191.01373	135.3
[M+Na]+	212.99567	149.6
[M+NH4]+	208.04027	144.5
[M+K]+	228.96961	142.5
[M-H]-	188.99917	137.7
[M+Na-2H]-	210.98112	142.6
[M]+	190.00590	138.6
[M]-	190.00700	138.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe