CID 14928441

N-(5-bromoquinoxalin-6-yl)guanidine

Structural Information

Molecular Formula
C9H8BrN5
SMILES
C1=CC2=NC=CN=C2C(=C1N=C(N)N)Br
InChI
InChI=1S/C9H8BrN5/c10-7-5(15-9(11)12)1-2-6-8(7)14-4-3-13-6/h1-4H,(H4,11,12,15)
InChIKey
WBGSURPVIDDDHF-UHFFFAOYSA-N
Compound name
2-(5-bromoquinoxalin-6-yl)guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.9963 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.00358 145.8
[M+Na]+ 287.98552 157.0
[M-H]- 263.98902 151.0
[M+NH4]+ 283.03012 163.8
[M+K]+ 303.95946 144.7
[M+H-H2O]+ 247.99356 143.0
[M+HCOO]- 309.99450 167.5
[M+CH3COO]- 324.01015 201.2
[M+Na-2H]- 285.97097 155.3
[M]+ 264.99575 161.3
[M]- 264.99685 161.3
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

No patent data available for this compound.