CID 49853485

3-bromo-5-(4-chlorophenoxy)pyridine

Structural Information

Molecular Formula
C11H7BrClNO
SMILES
C1=CC(=CC=C1OC2=CC(=CN=C2)Br)Cl
InChI
InChI=1S/C11H7BrClNO/c12-8-5-11(7-14-6-8)15-10-3-1-9(13)2-4-10/h1-7H
InChIKey
WBVDIRRTMMAHKU-UHFFFAOYSA-N
Compound name
3-bromo-5-(4-chlorophenoxy)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

282.93994 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.94722 147.9
[M+Na]+ 305.92916 161.5
[M-H]- 281.93266 156.1
[M+NH4]+ 300.97376 167.3
[M+K]+ 321.90310 148.6
[M+H-H2O]+ 265.93720 147.7
[M+HCOO]- 327.93814 165.3
[M+CH3COO]- 341.95379 163.2
[M+Na-2H]- 303.91461 156.9
[M]+ 282.93939 169.3
[M]- 282.94049 169.3
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