CID 21430517

5-chloroquinoxalin-6-amine

Structural Information

Molecular Formula
C8H6ClN3
SMILES
C1=CC2=NC=CN=C2C(=C1N)Cl
InChI
InChI=1S/C8H6ClN3/c9-7-5(10)1-2-6-8(7)12-4-3-11-6/h1-4H,10H2
InChIKey
ZWMOGBQIIIKCLO-UHFFFAOYSA-N
Compound name
5-chloroquinoxalin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

179.02502 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.03230 132.4
[M+Na]+ 202.01424 148.2
[M+NH4]+ 197.05884 142.0
[M+K]+ 217.98818 140.4
[M-H]- 178.01774 135.5
[M+Na-2H]- 199.99969 141.0
[M]+ 179.02447 135.9
[M]- 179.02557 135.9
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