CID 10704335

8-bromo-1,7-naphthyridin-6-amine

Structural Information

Molecular Formula
C8H6BrN3
SMILES
C1=CC2=CC(=NC(=C2N=C1)Br)N
InChI
InChI=1S/C8H6BrN3/c9-8-7-5(2-1-3-11-7)4-6(10)12-8/h1-4H,(H2,10,12)
InChIKey
VJKKBVMEHDGRAZ-UHFFFAOYSA-N
Compound name
8-bromo-1,7-naphthyridin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

122
Patents

222.9745 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.98178 137.7
[M+Na]+ 245.96372 142.7
[M+NH4]+ 241.00832 143.2
[M+K]+ 261.93766 142.0
[M-H]- 221.96722 139.0
[M+Na-2H]- 243.94917 142.5
[M]+ 222.97395 137.6
[M]- 222.97505 137.6
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

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