CID 154577493

2384921-30-4

Structural Information

Molecular Formula

C₆H₄BrN₃O

SMILES

C1=C(C=NC2=C1ON=C2N)Br

InChI

InChI=1S/C6H4BrN3O/c7-3-1-4-5(9-2-3)6(8)10-11-4/h1-2H,(H2,8,10)

InChIKey

DJULUCDSZJTOJN-UHFFFAOYSA-N

Compound name

6-bromo-[1,2]oxazolo[4,5-b]pyridin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 212.95377 Da
Monoisotopic Mass: 1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	213.96105	137.4
[M+Na]+	235.94299	141.6
[M+NH4]+	230.98759	142.2
[M+K]+	251.91693	143.7
[M-H]-	211.94649	138.7
[M+Na-2H]-	233.92844	140.5
[M]+	212.95322	137.1
[M]-	212.95432	137.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe