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3(eq)-(Benzyloxy-acetyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane

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3(eq)-(Benzyloxy-acetyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
SpectraBase Compound ID BmH5Ro4decL
InChI InChI=1S/C20H28O3S/c1-14-9-10-16-18(11-14)23-19(24-20(16,2)3)17(21)13-22-12-15-7-5-4-6-8-15/h4-8,14,16,18-19H,9-13H2,1-3H3/t14-,16-,18-,19-/m1/s1
InChIKey ABARSJVFPKTEES-YCEFEEMOSA-N
Mol Weight 348.5 g/mol
Molecular Formula C20H28O3S
Exact Mass 348.175916 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMaluY3CRB
Name 3(eq)-(Benzyloxy-acetyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
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Formula C20H28O3S
InChI InChI=1S/C20H28O3S/c1-14-9-10-16-18(11-14)23-19(24-20(16,2)3)17(21)13-22-12-15-7-5-4-6-8-15/h4-8,14,16,18-19H,9-13H2,1-3H3/t14-,16-,18-,19-/m1/s1
InChIKey ABARSJVFPKTEES-YCEFEEMOSA-N
Instrument Name Bruker WH-270
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