CID 163324818

6:2 fluorotelomer sulfonamido propionaldehyde

Structural Information

Molecular Formula
C11H10F13NO3S
SMILES
C(CNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C=O
InChI
InChI=1S/C11H10F13NO3S/c12-6(13,2-5-29(27,28)25-3-1-4-26)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24/h4,25H,1-3,5H2
InChIKey
JOZNZKNHTRLKIW-UHFFFAOYSA-N
Compound name
3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-N-(3-oxopropyl)octane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

483.0174 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 484.02468 169.4
[M+Na]+ 506.00662 175.2
[M-H]- 482.01012 174.5
[M+NH4]+ 501.05122 177.2
[M+K]+ 521.98056 180.1
[M+H-H2O]+ 466.01466 159.2
[M+HCOO]- 528.01560 189.6
[M+CH3COO]- 542.03125 232.5
[M+Na-2H]- 503.99207 166.3
[M]+ 483.01685 169.3
[M]- 483.01795 169.3
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

No patent data available for this compound.