CID 11065299

2-bromo-6-(4-methoxyphenyl)pyridine

Structural Information

Molecular Formula
C12H10BrNO
SMILES
COC1=CC=C(C=C1)C2=NC(=CC=C2)Br
InChI
InChI=1S/C12H10BrNO/c1-15-10-7-5-9(6-8-10)11-3-2-4-12(13)14-11/h2-8H,1H3
InChIKey
GBHNQKHQOCSREW-UHFFFAOYSA-N
Compound name
2-bromo-6-(4-methoxyphenyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

11
Patents

262.99457 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.00185 147.9
[M+Na]+ 285.98379 160.0
[M-H]- 261.98729 156.1
[M+NH4]+ 281.02839 167.1
[M+K]+ 301.95773 148.8
[M+H-H2O]+ 245.99183 146.9
[M+HCOO]- 307.99277 169.4
[M+CH3COO]- 322.00842 192.7
[M+Na-2H]- 283.96924 156.6
[M]+ 262.99402 167.6
[M]- 262.99512 167.6
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