CID 2776744

663-73-0

Structural Information

Molecular Formula

SMILES

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

InChI

InChI=1S/C3HClF4O/c4-1(9)3(7,8)2(5)6/h2H

InChIKey

BASQMECTPQYEIA-UHFFFAOYSA-N

Compound name

2,2,3,3-tetrafluoropropanoyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 99
Patents: 163.96521 Da
Monoisotopic Mass: 2.3
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]+	164.97249	119.0
[M+Na]+	186.95443	128.7
[M-H]-	162.95793	114.7
[M+NH4]+	181.99903	140.3
[M+K]+	202.92837	126.5
[M+H-H2O]+	146.96247	113.0
[M+HCOO]-	208.96341	132.1
[M+CH3COO]-	222.97906	176.3
[M+Na-2H]-	184.93988	123.5
[M]+	163.96466	115.0
[M]-	163.96576	115.0

Literature stripe

literature stripe

Patent stripe

patents stripe