CID 155977845

1-(6-chloro-3-fluoro-5-methylpyridin-2-yl)methanamine hydrochloride

Structural Information

Molecular Formula
C7H8ClFN2
SMILES
CC1=CC(=C(N=C1Cl)CN)F
InChI
InChI=1S/C7H8ClFN2/c1-4-2-5(9)6(3-10)11-7(4)8/h2H,3,10H2,1H3
InChIKey
IBIDWJXYQFVTDV-UHFFFAOYSA-N
Compound name
(6-chloro-3-fluoro-5-methylpyridin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.03601 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.04329 131.6
[M+Na]+ 197.02523 142.7
[M-H]- 173.02873 132.8
[M+NH4]+ 192.06983 151.7
[M+K]+ 212.99917 138.4
[M+H-H2O]+ 157.03327 125.6
[M+HCOO]- 219.03421 150.3
[M+CH3COO]- 233.04986 182.0
[M+Na-2H]- 195.01068 137.0
[M]+ 174.03546 131.5
[M]- 174.03656 131.5
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

No patent data available for this compound.