CID 9668

Ethanedioyl difluoride

Structural Information

Molecular Formula

C₂F₂O₂

SMILES

C(=O)(C(=O)F)F

InChI

InChI=1S/C2F2O2/c3-1(5)2(4)6

InChIKey

HXQOOYKLTKQCRR-UHFFFAOYSA-N

Compound name

oxalyl difluoride

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 478
Patents: 93.98663 Da
Monoisotopic Mass: 0.7
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]+	94.993906	107.8
[M+Na]+	116.97585	116.9
[M-H]-	92.979354	106.2
[M+NH4]+	112.02045	131.1
[M+K]+	132.94979	117.6
[M+H-H2O]+	76.983890	102.4
[M+HCOO]-	138.98483	129.8
[M+CH3COO]-	153.00048	164.4
[M+Na-2H]-	114.96130	113.6
[M]+	93.986081	105.4
[M]-	93.987179	105.4

Literature stripe

literature stripe

Patent stripe

patents stripe