CID 19890818

5-chloro-6-(propan-2-yloxy)pyridin-3-amine

Structural Information

Molecular Formula
C8H11ClN2O
SMILES
CC(C)OC1=C(C=C(C=N1)N)Cl
InChI
InChI=1S/C8H11ClN2O/c1-5(2)12-8-7(9)3-6(10)4-11-8/h3-5H,10H2,1-2H3
InChIKey
CDECSSNEHBQLGS-UHFFFAOYSA-N
Compound name
5-chloro-6-propan-2-yloxypyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

186.05598 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.06326 137.3
[M+Na]+ 209.04520 146.6
[M-H]- 185.04870 139.5
[M+NH4]+ 204.08980 156.6
[M+K]+ 225.01914 143.5
[M+H-H2O]+ 169.05324 131.7
[M+HCOO]- 231.05418 155.9
[M+CH3COO]- 245.06983 184.1
[M+Na-2H]- 207.03065 142.2
[M]+ 186.05543 139.1
[M]- 186.05653 139.1
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