CID 10511120

2-chloro-4,6-dimethylpyridin-3-amine

Structural Information

Molecular Formula
C7H9ClN2
SMILES
CC1=CC(=NC(=C1N)Cl)C
InChI
InChI=1S/C7H9ClN2/c1-4-3-5(2)10-7(8)6(4)9/h3H,9H2,1-2H3
InChIKey
PDPCDUNCJYNCDR-UHFFFAOYSA-N
Compound name
2-chloro-4,6-dimethylpyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

67
Patents

156.04543 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.05271 129.5
[M+Na]+ 179.03465 140.6
[M-H]- 155.03815 132.2
[M+NH4]+ 174.07925 150.4
[M+K]+ 195.00859 136.7
[M+H-H2O]+ 139.04269 124.6
[M+HCOO]- 201.04363 149.2
[M+CH3COO]- 215.05928 179.3
[M+Na-2H]- 177.02010 135.4
[M]+ 156.04488 130.5
[M]- 156.04598 130.5
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