CID 12275767

2,4-difluoro-5-nitropyridine

Structural Information

Molecular Formula

C₅H₂F₂N₂O₂

SMILES

C1=C(C(=CN=C1F)[N+](=O)[O-])F

InChI

InChI=1S/C5H2F2N2O2/c6-3-1-5(7)8-2-4(3)9(10)11/h1-2H

InChIKey

OLPMWQXRTRVQRS-UHFFFAOYSA-N

Compound name

2,4-difluoro-5-nitropyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 67
Patents: 160.00844 Da
Monoisotopic Mass: 1.2
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]+	161.01572	122.0
[M+Na]+	182.99766	134.6
[M+NH4]+	178.04226	129.1
[M+K]+	198.97160	132.0
[M-H]-	159.00116	122.0
[M+Na-2H]-	180.98311	128.3
[M]+	160.00789	123.5
[M]-	160.00899	123.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe