CID 46835230

1-(2-chloropyridin-4-yl)ethanamine

Structural Information

Molecular Formula
C7H9ClN2
SMILES
CC(C1=CC(=NC=C1)Cl)N
InChI
InChI=1S/C7H9ClN2/c1-5(9)6-2-3-10-7(8)4-6/h2-5H,9H2,1H3
InChIKey
QVYJLHKUZZRYEH-UHFFFAOYSA-N
Compound name
1-(2-chloropyridin-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

156.04543 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.05271 129.2
[M+Na]+ 179.03465 142.7
[M+NH4]+ 174.07925 138.5
[M+K]+ 195.00859 136.1
[M-H]- 155.03815 131.8
[M+Na-2H]- 177.02010 136.9
[M]+ 156.04488 132.1
[M]- 156.04598 132.1
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