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5,11,17,23-Tetrakis(T-butyl)-28-benzyloxy-pentacyclo(19,3.1.1/3,7/.1/9,13/.1/15,19/)octacosa-dodecene-25,26,27-triol
SpectraBase Compound ID EkTEgYQXNoW
InChI InChI=1S/C51H62O4/c1-48(2,3)40-22-32-18-34-24-41(49(4,5)6)26-36(45(34)53)20-38-28-43(51(10,11)12)29-39(47(38)55-30-31-16-14-13-15-17-31)21-37-27-42(50(7,8)9)25-35(46(37)54)19-33(23-40)44(32)52/h13-17,22-29,52-54H,18-21,30H2,1-12H3
InChIKey UJIYFKPPAWOGEA-UHFFFAOYSA-N
Mol Weight 739.1 g/mol
Molecular Formula C51H62O4
Exact Mass 738.46481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KmoXQf6sJKt
Name 5,11,17,23-Tetrakis(T-butyl)-28-benzyloxy-pentacyclo(19,3.1.1/3,7/.1/9,13/.1/15,19/)octacosa-dodecene-25,26,27-triol
Comments BRUKER AC100 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C51H62O4
InChI InChI=1S/C51H62O4/c1-48(2,3)40-22-32-18-34-24-41(49(4,5)6)26-36(45(34)53)20-38-28-43(51(10,11)12)29-39(47(38)55-30-31-16-14-13-15-17-31)21-37-27-42(50(7,8)9)25-35(46(37)54)19-33(23-40)44(32)52/h13-17,22-29,52-54H,18-21,30H2,1-12H3
InChIKey UJIYFKPPAWOGEA-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference A. Casnati, A. Arduini, R. Ungaro, Tetrahedron 47, 2221 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3