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4-(1,7-Dioxa-spiro<5.5>undec-4-en-2-yl)-2-hydroxy-2-methyl-butyl toluene-P-sulfonate
SpectraBase Compound ID B9kuG2sZE0E
InChI InChI=1S/C21H30O6S/c1-17-7-9-19(10-8-17)28(23,24)26-16-20(2,22)14-11-18-6-5-13-21(27-18)12-3-4-15-25-21/h5,7-10,13,18,22H,3-4,6,11-12,14-16H2,1-2H3
InChIKey YATAEDRYJICKRF-UHFFFAOYSA-N
Mol Weight 410.53 g/mol
Molecular Formula C21H30O6S
Exact Mass 410.17631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KnOEk7Nioou
Name 4-(1,7-Dioxa-spiro<5.5>undec-4-en-2-yl)-2-hydroxy-2-methyl-butyl toluene-P-sulfonate
Comments 67.8 MHZ SPECTRUM, ADDITIONAL SIGNALS PRESENT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H30O6S
InChI InChI=1S/C21H30O6S/c1-17-7-9-19(10-8-17)28(23,24)26-16-20(2,22)14-11-18-6-5-13-21(27-18)12-3-4-15-25-21/h5,7-10,13,18,22H,3-4,6,11-12,14-16H2,1-2H3
InChIKey YATAEDRYJICKRF-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference M.A. Brimble, G.M. Williams, R.Baker, J. Chem. Soc. Perkin I 2221 (1991).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3