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para-Fluorobenzensulphonic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester

View entire compound with spectra: 2 NMR

para-Fluorobenzensulphonic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester
SpectraBase Compound ID 4QoOf0YU2aC
InChI InChI=1S/C11H7F9O3S/c12-6-1-3-7(4-2-6)24(21,22)23-5-9(15,16)11(19,20)10(17,18)8(13)14/h1-4,8H,5H2
InChIKey NOGWSVXZXWGTOL-UHFFFAOYSA-N
Mol Weight 390.22 g/mol
Molecular Formula C11H7F9O3S
Exact Mass 389.997219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ypUtutTj5j
Name para-Fluorobenzensulphonic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.997218723 u
Formula C11H7F9O3S
InChI InChI=1S/C11H7F9O3S/c12-6-1-3-7(4-2-6)24(21,22)23-5-9(15,16)11(19,20)10(17,18)8(13)14/h1-4,8H,5H2
InChIKey NOGWSVXZXWGTOL-UHFFFAOYSA-N
Molecular Weight 390.220 g/mol
SMILES c1(ccc(cc1)F)S(=O)(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O