CID 84820084

2-chloro-5-methoxypyridin-4-amine

Structural Information

Molecular Formula
C6H7ClN2O
SMILES
COC1=CN=C(C=C1N)Cl
InChI
InChI=1S/C6H7ClN2O/c1-10-5-3-9-6(7)2-4(5)8/h2-3H,1H3,(H2,8,9)
InChIKey
LDBLGEXLMHNSJY-UHFFFAOYSA-N
Compound name
2-chloro-5-methoxypyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

158.02469 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.031966 127.9
[M+Na]+ 181.013908 138.3
[M-H]- 157.017414 130.3
[M+NH4]+ 176.058513 148.3
[M+K]+ 196.987848 135.2
[M+H-H2O]+ 141.021950 122.6
[M+HCOO]- 203.022891 148.2
[M+CH3COO]- 217.038541 177.1
[M+Na-2H]- 178.999356 135.1
[M]+ 158.02414142 129.5
[M]- 158.02523858 129.5
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

patents stripe