CID 111914

N-ethylpentadecafluoro-1-heptanesulfonamide

Structural Information

Molecular Formula
C9H6F15NO2S
SMILES
CCNS(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C9H6F15NO2S/c1-2-25-28(26,27)9(23,24)7(18,19)5(14,15)3(10,11)4(12,13)6(16,17)8(20,21)22/h25H,2H2,1H3
InChIKey
WMOMXEHEPXLIAV-UHFFFAOYSA-N
Compound name
N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

476.98798 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 477.99526 171.9
[M+Na]+ 499.97720 171.8
[M+NH4]+ 495.02180 171.3
[M+K]+ 515.95114 171.3
[M-H]- 475.98070 169.2
[M+Na-2H]- 497.96265 171.1
[M]+ 476.98743 171.1
[M]- 476.98853 171.1
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