CID 87793813

Perfluoropentane sulfonamide

Structural Information

Molecular Formula
C5H2F11NO2S
SMILES
C(C(C(F)(F)F)(F)F)(C(C(F)(F)S(=O)(=O)N)(F)F)(F)F
InChI
InChI=1S/C5H2F11NO2S/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)20(17,18)19/h(H2,17,18,19)
InChIKey
KTCODRNGNIXYDE-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

14
Patents

348.96307 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.97035 156.1
[M+Na]+ 371.95229 164.9
[M-H]- 347.95579 143.3
[M+NH4]+ 366.99689 167.8
[M+K]+ 387.92623 161.7
[M+H-H2O]+ 331.96033 143.5
[M+HCOO]- 393.96127 155.5
[M+CH3COO]- 407.97692 208.7
[M+Na-2H]- 369.93774 159.8
[M]+ 348.96252 139.8
[M]- 348.96362 139.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe