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3(eq)-(1(R),2-Dihydroxy-ethyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
SpectraBase Compound ID 8cqqk3Qwo8e
InChI InChI=1S/C13H24O3S/c1-8-4-5-9-11(6-8)16-12(10(15)7-14)17-13(9,2)3/h8-12,14-15H,4-7H2,1-3H3/t8-,9-,10?,11-,12-/m1/s1
InChIKey AEPYAPSTWRMRIU-ASCZTPFHSA-N
Mol Weight 260.39 g/mol
Molecular Formula C13H24O3S
Exact Mass 260.144616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B79sx21ytyG
Name 3(eq)-(1(S),2-Dihydroxy-ethyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
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Formula C13H24O3S
InChI InChI=1S/C13H24O3S/c1-8-4-5-9-11(6-8)16-12(10(15)7-14)17-13(9,2)3/h8-12,14-15H,4-7H2,1-3H3/t8-,9-,10?,11-,12-/m1/s1
InChIKey AEPYAPSTWRMRIU-ASCZTPFHSA-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