CID 15515118

6-chloro-n-methylpyridin-3-amine

Structural Information

Molecular Formula
C6H7ClN2
SMILES
CNC1=CN=C(C=C1)Cl
InChI
InChI=1S/C6H7ClN2/c1-8-5-2-3-6(7)9-4-5/h2-4,8H,1H3
InChIKey
LFRYVKXHKZPNED-UHFFFAOYSA-N
Compound name
6-chloro-N-methylpyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

359
Patents

142.02977 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.03705 124.5
[M+Na]+ 165.01899 134.1
[M-H]- 141.02249 127.1
[M+NH4]+ 160.06359 145.6
[M+K]+ 180.99293 130.8
[M+H-H2O]+ 125.02703 119.1
[M+HCOO]- 187.02797 145.2
[M+CH3COO]- 201.04362 174.7
[M+Na-2H]- 163.00444 133.6
[M]+ 142.02922 125.4
[M]- 142.03032 125.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe