CID 6485400

3-chloro-2-(pyridin-3-yloxy)aniline

Structural Information

Molecular Formula
C11H9ClN2O
SMILES
C1=CC(=C(C(=C1)Cl)OC2=CN=CC=C2)N
InChI
InChI=1S/C11H9ClN2O/c12-9-4-1-5-10(13)11(9)15-8-3-2-6-14-7-8/h1-7H,13H2
InChIKey
GVHXELSOINPUQV-UHFFFAOYSA-N
Compound name
3-chloro-2-pyridin-3-yloxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.04034 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.04762 144.6
[M+Na]+ 243.02956 154.3
[M-H]- 219.03306 149.8
[M+NH4]+ 238.07416 162.0
[M+K]+ 259.00350 149.2
[M+H-H2O]+ 203.03760 137.4
[M+HCOO]- 265.03854 164.7
[M+CH3COO]- 279.05419 157.8
[M+Na-2H]- 241.01501 151.8
[M]+ 220.03979 145.7
[M]- 220.04089 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

No patent data available for this compound.