CID 45079594

6-chloro-5-methylpyridin-2-amine

Structural Information

Molecular Formula
C6H7ClN2
SMILES
CC1=C(N=C(C=C1)N)Cl
InChI
InChI=1S/C6H7ClN2/c1-4-2-3-5(8)9-6(4)7/h2-3H,1H3,(H2,8,9)
InChIKey
KPZRCZMNXPBHEH-UHFFFAOYSA-N
Compound name
6-chloro-5-methylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

256
Patents

142.02977 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.037046 125.0
[M+Na]+ 165.018988 135.5
[M-H]- 141.022494 127.4
[M+NH4]+ 160.063593 146.1
[M+K]+ 180.992928 131.9
[M+H-H2O]+ 125.027030 120.0
[M+HCOO]- 187.027971 145.0
[M+CH3COO]- 201.043621 175.1
[M+Na-2H]- 163.004436 132.2
[M]+ 142.02922142 125.2
[M]- 142.03031858 125.2
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