CID 84697178

6-bromo-2-chloro-[1,3]oxazolo[4,5-b]pyridine

Structural Information

Molecular Formula
C6H2BrClN2O
SMILES
C1=C(C=NC2=C1OC(=N2)Cl)Br
InChI
InChI=1S/C6H2BrClN2O/c7-3-1-4-5(9-2-3)10-6(8)11-4/h1-2H
InChIKey
CEGCWRUMZAVLHG-UHFFFAOYSA-N
Compound name
6-bromo-2-chloro-[1,3]oxazolo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.9039 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.91118 138.5
[M+Na]+ 254.89312 144.9
[M+NH4]+ 249.93772 144.1
[M+K]+ 270.86706 145.5
[M-H]- 230.89662 139.8
[M+Na-2H]- 252.87857 142.4
[M]+ 231.90335 139.0
[M]- 231.90445 139.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.