CID 620880

4-[(3,5-dichloro-2-pyridinyl)oxy]phenol

Structural Information

Molecular Formula
C11H7Cl2NO2
SMILES
C1=CC(=CC=C1O)OC2=C(C=C(C=N2)Cl)Cl
InChI
InChI=1S/C11H7Cl2NO2/c12-7-5-10(13)11(14-6-7)16-9-3-1-8(15)2-4-9/h1-6,15H
InChIKey
NWFAJOGQUGZVOS-UHFFFAOYSA-N
Compound name
4-[(3,5-dichloro-2-pyridinyl)oxy]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

116
Patents

254.98538 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.992656 147.7
[M+Na]+ 277.974598 159.0
[M-H]- 253.978104 151.8
[M+NH4]+ 273.019203 164.3
[M+K]+ 293.948538 153.0
[M+H-H2O]+ 237.982640 141.8
[M+HCOO]- 299.983581 161.0
[M+CH3COO]- 313.999231 160.6
[M+Na-2H]- 275.960046 153.7
[M]+ 254.98483142 151.7
[M]- 254.98592858 151.7
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