CID 102441610

Dtxsid60896128

Structural Information

Molecular Formula
C10H14F9NO4S
SMILES
COCCN(CCOC)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10H14F9NO4S/c1-23-5-3-20(4-6-24-2)25(21,22)10(18,19)8(13,14)7(11,12)9(15,16)17/h3-6H2,1-2H3
InChIKey
HDBRXVSINCDTJD-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(2-methoxyethyl)butane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

415.05 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 416.05728 177.8
[M+Na]+ 438.03922 184.3
[M-H]- 414.04272 167.9
[M+NH4]+ 433.08382 178.5
[M+K]+ 454.01316 182.8
[M+H-H2O]+ 398.04726 165.2
[M+HCOO]- 460.04820 188.3
[M+CH3COO]- 474.06385 223.9
[M+Na-2H]- 436.02467 180.5
[M]+ 415.04945 172.0
[M]- 415.05055 172.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe