CID 420644

6-(4-chlorophenoxy)pyridin-3-amine

Structural Information

Molecular Formula
C11H9ClN2O
SMILES
C1=CC(=CC=C1OC2=NC=C(C=C2)N)Cl
InChI
InChI=1S/C11H9ClN2O/c12-8-1-4-10(5-2-8)15-11-6-3-9(13)7-14-11/h1-7H,13H2
InChIKey
POEUJOWYZVKVMS-UHFFFAOYSA-N
Compound name
6-(4-chlorophenoxy)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

220.04034 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.047616 144.6
[M+Na]+ 243.029558 154.3
[M-H]- 219.033064 149.8
[M+NH4]+ 238.074163 162.0
[M+K]+ 259.003498 149.2
[M+H-H2O]+ 203.037600 137.4
[M+HCOO]- 265.038541 164.7
[M+CH3COO]- 279.054191 157.8
[M+Na-2H]- 241.015006 151.8
[M]+ 220.03979142 145.7
[M]- 220.04088858 145.7
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