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

9
Patents

190.00645 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.01373 135.5
[M+Na]+ 212.99567 145.6
[M-H]- 188.99917 137.0
[M+NH4]+ 208.04027 154.9
[M+K]+ 228.96961 140.7
[M+H-H2O]+ 173.00371 130.9
[M+HCOO]- 235.00465 149.0
[M+CH3COO]- 249.02030 183.8
[M+Na-2H]- 210.98112 140.1
[M]+ 190.00590 136.4
[M]- 190.00700 136.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe