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3(eq)-(3-Benzyloxy-1(R)-hydroxy-1-methyl-propyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane

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3(eq)-(3-Benzyloxy-1(R)-hydroxy-1-methyl-propyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
SpectraBase Compound ID 6eP0WbhnOrS
InChI InChI=1S/C22H34O3S/c1-16-10-11-18-19(14-16)25-20(26-21(18,2)3)22(4,23)12-13-24-15-17-8-6-5-7-9-17/h5-9,16,18-20,23H,10-15H2,1-4H3/t16-,18-,19-,20-,22?/m1/s1
InChIKey KHERRPMMNVOTKR-OKMKSZLCSA-N
Mol Weight 378.6 g/mol
Molecular Formula C22H34O3S
Exact Mass 378.222866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5KKnJOWr0wP
Name 3(eq)-(3-Benzyloxy-1(S)-hydroxy-1-methyl-propyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H34O3S
InChI InChI=1S/C22H34O3S/c1-16-10-11-18-19(14-16)25-20(26-21(18,2)3)22(4,23)12-13-24-15-17-8-6-5-7-9-17/h5-9,16,18-20,23H,10-15H2,1-4H3/t16-,18-,19-,20-,22?/m1/s1
InChIKey KHERRPMMNVOTKR-OKMKSZLCSA-N
Instrument Name Varian XL-400
Literature Reference S.V. Frye, E.L. Eliel, J. Am. Chem. Soc. 110, 484 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3