CID 46864136

6-bromo-3-chloroquinoxalin-2-amine

Structural Information

Molecular Formula
C8H5BrClN3
SMILES
C1=CC2=C(C=C1Br)N=C(C(=N2)N)Cl
InChI
InChI=1S/C8H5BrClN3/c9-4-1-2-5-6(3-4)12-7(10)8(11)13-5/h1-3H,(H2,11,13)
InChIKey
OHECRYPLGOMEBE-UHFFFAOYSA-N
Compound name
6-bromo-3-chloroquinoxalin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.93555 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.94283 141.2
[M+Na]+ 279.92477 156.1
[M-H]- 255.92827 145.9
[M+NH4]+ 274.96937 161.2
[M+K]+ 295.89871 142.4
[M+H-H2O]+ 239.93281 140.9
[M+HCOO]- 301.93375 156.9
[M+CH3COO]- 315.94940 156.3
[M+Na-2H]- 277.91022 151.0
[M]+ 256.93500 160.6
[M]- 256.93610 160.6
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.