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3(eq)-(3-Hydroxy-1-oxo-propyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
SpectraBase Compound ID CNqzJ9FBEMF
InChI InChI=1S/C14H24O3S/c1-9-4-5-10-12(8-9)17-13(11(16)6-7-15)18-14(10,2)3/h9-10,12-13,15H,4-8H2,1-3H3/t9-,10-,12-,13-/m1/s1
InChIKey PYDNFPGLYACMBQ-FPQZTECRSA-N
Mol Weight 272.4 g/mol
Molecular Formula C14H24O3S
Exact Mass 272.144616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FSpejMGffzN
Name 3(eq)-(3-Hydroxy-1-oxo-propyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
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Formula C14H24O3S
InChI InChI=1S/C14H24O3S/c1-9-4-5-10-12(8-9)17-13(11(16)6-7-15)18-14(10,2)3/h9-10,12-13,15H,4-8H2,1-3H3/t9-,10-,12-,13-/m1/s1
InChIKey PYDNFPGLYACMBQ-FPQZTECRSA-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