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3(eq)-(3-Benzyloxy-1-oxo-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-oxo-propyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
SpectraBase Compound ID 8rpn5RQpX48
InChI InChI=1S/C21H30O3S/c1-15-9-10-17-19(13-15)24-20(25-21(17,2)3)18(22)11-12-23-14-16-7-5-4-6-8-16/h4-8,15,17,19-20H,9-14H2,1-3H3/t15-,17-,19-,20-/m1/s1
InChIKey UMXHVIPPANGUQZ-RARDXLECSA-N
Mol Weight 362.53 g/mol
Molecular Formula C21H30O3S
Exact Mass 362.191566 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5SouYPt4Dtg
Name 3(eq)-(3-Benzyloxy-1-oxo-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 C21H30O3S
InChI InChI=1S/C21H30O3S/c1-15-9-10-17-19(13-15)24-20(25-21(17,2)3)18(22)11-12-23-14-16-7-5-4-6-8-16/h4-8,15,17,19-20H,9-14H2,1-3H3/t15-,17-,19-,20-/m1/s1
InChIKey UMXHVIPPANGUQZ-RARDXLECSA-N
Instrument Name Bruker WM-250
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