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4-((S,S)-2,3-Epoxy-(S)-1-hydroxy-2-nonyl)-benzoic acid, 4-decyloxy-phenyl ester
SpectraBase Compound ID 5lt5Awqhofl
InChI InChI=1S/C32H46O5/c1-3-5-7-9-10-11-12-14-24-35-27-20-22-28(23-21-27)36-32(34)26-18-16-25(17-19-26)30(33)31-29(37-31)15-13-8-6-4-2/h16-23,29-31,33H,3-15,24H2,1-2H3
InChIKey HUVUODABEGYIHC-UHFFFAOYSA-N
Mol Weight 510.7 g/mol
Molecular Formula C32H46O5
Exact Mass 510.334525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ex1VJBDycN
Name 4-((S,S)-2,3-Epoxy-(S)-1-hydroxy-2-nonyl)-benzoic acid, 4-decyloxy-phenyl ester
CAS Registry Number 117438-58-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C32H46O5
InChI InChI=1S/C32H46O5/c1-3-5-7-9-10-11-12-14-24-35-27-20-22-28(23-21-27)36-32(34)26-18-16-25(17-19-26)30(33)31-29(37-31)15-13-8-6-4-2/h16-23,29-31,33H,3-15,24H2,1-2H3
InChIKey HUVUODABEGYIHC-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference D.M. Walba, H.A. Razavi, N.A.Clark, J. Am. Chem. Soc. 110, 8686 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3