CID 762079

2-(4-bromophenyl)quinoxaline

Structural Information

Molecular Formula
C14H9BrN2
SMILES
C1=CC=C2C(=C1)N=CC(=N2)C3=CC=C(C=C3)Br
InChI
InChI=1S/C14H9BrN2/c15-11-7-5-10(6-8-11)14-9-16-12-3-1-2-4-13(12)17-14/h1-9H
InChIKey
FXKZRBJBUFVFNR-UHFFFAOYSA-N
Compound name
2-(4-bromophenyl)quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

55
Patents

283.9949 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.00218 154.5
[M+Na]+ 306.98412 166.9
[M-H]- 282.98762 162.1
[M+NH4]+ 302.02872 172.3
[M+K]+ 322.95806 154.4
[M+H-H2O]+ 266.99216 152.8
[M+HCOO]- 328.99310 173.6
[M+CH3COO]- 343.00875 168.7
[M+Na-2H]- 304.96957 165.0
[M]+ 283.99435 172.7
[M]- 283.99545 172.7
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