(1R,2S,5S)-4-Benzyloxy-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl Nonaflate

SpectraBase Compound ID	Hez19OsnywX
InChI	InChI=1S/C18H13F9O5S/c19-15(20,17(23,24)25)16(21,22)18(26,27)33(28,29)32-13-8-11-6-7-12(31-11)14(13)30-9-10-4-2-1-3-5-10/h1-8,11-12,14H,9H2/t11-,12+,14-/m0/s1
InChIKey	XBEBPUDDJCZTPN-SCRDCRAPSA-N Google Search
Mol Weight	512.34 g/mol
Molecular Formula	C18H13F9O5S
Exact Mass	512.033998 g/mol

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SpectraBase Spectrum ID	Fq5SINAEFEy
Name	(1R,2S,5S)-4-Benzyloxy-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl Nonaflate
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H13F9O5S
InChI	InChI=1S/C18H13F9O5S/c19-15(20,17(23,24)25)16(21,22)18(26,27)33(28,29)32-13-8-11-6-7-12(31-11)14(13)30-9-10-4-2-1-3-5-10/h1-8,11-12,14H,9H2/t11-,12+,14-/m0/s1
InChIKey	XBEBPUDDJCZTPN-SCRDCRAPSA-N
Literature Reference DOI	10.1002/adsc.200404194
Molecular Weight	512.343 g/mol
SMILES	C(F)(S(=O)(=O)OC=1[C@]([C@]2(C=C[C@@](C1)(O2)[H])[H])(OCc1ccccc1)[H])(C(C(C(F)(F)F)(F)F)(F)F)F
SPLASH	splash10-0006-9000000000-03d06cba4148c4054093
Source of Spectrum	ASC-346-1873-6
Synonyms	(1R,2S,5S)-2-(benzyloxy)-8-oxabicyclo[3.2.1]octa-3,6-dien-3-yl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
Wiley ID	1767530