CID 2802176

10186-68-2

Structural Information

Molecular Formula

C₅H₇F₄NO₂

SMILES

CCOC(C(=O)N)(C(F)(F)F)F

InChI

InChI=1S/C5H7F4NO2/c1-2-12-4(6,3(10)11)5(7,8)9/h2H2,1H3,(H2,10,11)

InChIKey

LPKUKZHFTQYNDK-UHFFFAOYSA-N

Compound name

2-ethoxy-2,3,3,3-tetrafluoropropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 4
Patents: 189.04129 Da
Monoisotopic Mass: 0.8
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]+	190.04857	132.6
[M+Na]+	212.03051	140.5
[M-H]-	188.03401	127.6
[M+NH4]+	207.07511	151.6
[M+K]+	228.00445	140.0
[M+H-H2O]+	172.03855	125.2
[M+HCOO]-	234.03949	149.4
[M+CH3COO]-	248.05514	183.4
[M+Na-2H]-	210.01596	137.3
[M]+	189.04074	126.9
[M]-	189.04184	126.9

Literature stripe

literature stripe

Patent stripe

patents stripe