CID 11252905

Pentafluoroethanesulfonamide

Structural Information

Molecular Formula

C₂H₂F₅NO₂S

SMILES

C(C(F)(F)S(=O)(=O)N)(F)(F)F

InChI

InChI=1S/C2H2F5NO2S/c3-1(4,5)2(6,7)11(8,9)10/h(H2,8,9,10)

InChIKey

QDUKVMNUAQTMQW-UHFFFAOYSA-N

Compound name

1,1,2,2,2-pentafluoroethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 714
Patents: 198.97264 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]+	199.97992	127.6
[M+Na]+	221.96186	137.0
[M-H]-	197.96536	121.7
[M+NH4]+	217.00646	146.3
[M+K]+	237.93580	134.9
[M+H-H2O]+	181.96990	119.5
[M+HCOO]-	243.97084	138.4
[M+CH3COO]-	257.98649	180.0
[M+Na-2H]-	219.94731	132.1
[M]+	198.97209	120.8
[M]-	198.97319	120.8

Literature stripe

literature stripe

Patent stripe

patents stripe