CID 3022848

93894-54-3

Structural Information

Molecular Formula
C8H11F8NO4S
SMILES
C(CO)N(CCO)S(=O)(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C8H11F8NO4S/c9-5(10)6(11,12)7(13,14)8(15,16)22(20,21)17(1-3-18)2-4-19/h5,18-19H,1-4H2
InChIKey
QUQDQNCPLSSGOU-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4-octafluoro-N,N-bis(2-hydroxyethyl)butane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

369.0281 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.035376 164.6
[M+Na]+ 392.017318 170.2
[M-H]- 368.020824 152.9
[M+NH4]+ 387.061923 175.2
[M+K]+ 407.991258 167.8
[M+H-H2O]+ 352.025360 153.2
[M+HCOO]- 414.026301 166.6
[M+CH3COO]- 428.041951 211.4
[M+Na-2H]- 390.002766 165.5
[M]+ 369.02755142 156.0
[M]- 369.02864858 156.0
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

No patent data available for this compound.