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(2RS, 3Sr,4RS)-2,4-dimethyl-3-hydroxy-2-methoxy-4-phenyl-butanoic acid, 4-methyl-2,6-di-tert-butyl-phenyl ester
SpectraBase Compound ID F0jGgszgwf3
InChI InChI=1S/C28H40O4/c1-18-16-21(26(3,4)5)23(22(17-18)27(6,7)8)32-25(30)28(9,31-10)24(29)19(2)20-14-12-11-13-15-20/h11-17,19,24,29H,1-10H3
InChIKey OREYEQWCUQGRSA-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C28H40O4
Exact Mass 440.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8BnCuKVm512
Name (2RS, 3Sr,4RS)-2,4-dimethyl-3-hydroxy-2-methoxy-4-phenyl-butanoic acid, 4-methyl-2,6-di-tert-butyl-phenyl ester
CAS Registry Number 92817-85-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H40O4
InChI InChI=1S/C28H40O4/c1-18-16-21(26(3,4)5)23(22(17-18)27(6,7)8)32-25(30)28(9,31-10)24(29)19(2)20-14-12-11-13-15-20/h11-17,19,24,29H,1-10H3
InChIKey OREYEQWCUQGRSA-UHFFFAOYSA-N
Literature Reference C.H. Heathcock, M.C. Pirrung, S.D.Young, J. Am. Chem. Soc. 106, 8161 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3