SpectraBase Spectrum ID |
6B0bqatjVPN |
Name |
1-(Perfluoroctanylsulfonyl)-4-methylpiperidine |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
581.031728573 u |
Formula |
C14H12F17NO2S |
InChI |
InChI=1S/C14H12F17NO2S/c1-6-2-4-32(5-3-6)35(33,34)14(30,31)12(25,26)10(21,22)8(17,18)7(15,16)9(19,20)11(23,24)13(27,28)29/h6H,2-5H2,1H3 |
InChIKey |
XUJDACCYBNROBW-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
581.288 g/mol |
Nominal Mass |
581 u |
Quality |
882 |
Retention Index |
1446 |
SMILES |
C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(S(N1CCC(CC1)C)(=O)=O)(F)F)(F)F)(F)F |
SPLASH |
splash10-052b-9400000000-821e9840cc8d2f535806 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Piperidine,1-(perfluoroctanylsulfonyl)-4-methyl
1-((1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)sulfonyl)-4-methylpiperidine |
Technique |
GC/MS |
Wiley ID |
DD2024_006034 |