CID 71757148

1211529-07-5

Structural Information

Molecular Formula

C₆H₂Cl₂N₂O

SMILES

C1=C(C=NC2=C1OC(=N2)Cl)Cl

InChI

InChI=1S/C6H2Cl2N2O/c7-3-1-4-5(9-2-3)10-6(8)11-4/h1-2H

InChIKey

UXHZPPFUUBFDIP-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 187.95442 Da
Monoisotopic Mass: 2.6
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]+	188.961696	129.9
[M+Na]+	210.943638	143.9
[M-H]-	186.947144	132.6
[M+NH4]+	205.988243	150.2
[M+K]+	226.917578	140.1
[M+H-H2O]+	170.951680	124.3
[M+HCOO]-	232.952621	144.0
[M+CH3COO]-	246.968271	144.8
[M+Na-2H]-	208.929086	138.9
[M]+	187.95387142	136.1
[M]-	187.95496858	136.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe