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10,20-Dimethyl-3,7,11,15,19,23,27-heptaoxa-2,8,18,28-tetraoxo-bicyclo(27.4.0)tritriacontane-30,33-diol
SpectraBase Compound ID FU1150vNDJE
InChI InChI=1S/C28H46O13/c1-19-7-15-35-11-3-13-38-27(33)25-21(29)5-6-22(30)26(25)28(34)39-14-4-12-36-16-8-20(2)41-24(32)10-18-37-17-9-23(31)40-19/h19-22,25-26,29-30H,3-18H2,1-2H3
InChIKey RBJMITDLCLVISO-UHFFFAOYSA-N
Mol Weight 590.7 g/mol
Molecular Formula C28H46O13
Exact Mass 590.293842 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1lKDxff8rzE
Name 10,20-Dimethyl-3,7,11,15,19,23,27-heptaoxa-2,8,18,28-tetraoxo-bicyclo(27.4.0)tritriacontane-30,33-diol
Comments STRUCTURE IS CHANGED TO DIOLFORM - REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H46O13
InChI InChI=1S/C28H46O13/c1-19-7-15-35-11-3-13-38-27(33)25-21(29)5-6-22(30)26(25)28(34)39-14-4-12-36-16-8-20(2)41-24(32)10-18-37-17-9-23(31)40-19/h19-22,25-26,29-30H,3-18H2,1-2H3
InChIKey RBJMITDLCLVISO-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference M.E. Bibout, A. Samat, R. Faure, J. Elguero, Magn. Res. Chem. 23, 137 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3