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Hexahydro-4,7,7-trimethyl-8-(phenyl-acetyl)-trans-benzoxathiane

View entire compound with spectra: 1 NMR

Hexahydro-4,7,7-trimethyl-8-(phenyl-acetyl)-trans-benzoxathiane
SpectraBase Compound ID KvKSJybkj4S
InChI InChI=1S/C18H24O2S/c1-12-9-10-14-15(11-12)20-17(21-18(14,2)3)16(19)13-7-5-4-6-8-13/h4-8,12,14-15,17H,9-11H2,1-3H3/t12-,14-,15-,17-/m1/s1
InChIKey FWDLEWKUCGTCQC-DNNBLBMLSA-N
Mol Weight 304.45 g/mol
Molecular Formula C18H24O2S
Exact Mass 304.149701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LyAi4jeOoOx
Name Hexahydro-4,7,7-trimethyl-8-(phenyl-acetyl)-trans-benzoxathiane
Comments reassigned
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Formula C18H24O2S
InChI InChI=1S/C18H24O2S/c1-12-9-10-14-15(11-12)20-17(21-18(14,2)3)16(19)13-7-5-4-6-8-13/h4-8,12,14-15,17H,9-11H2,1-3H3/t12-,14-,15-,17-/m1/s1
InChIKey FWDLEWKUCGTCQC-DNNBLBMLSA-N
Instrument Name Bruker WM-250
Literature Reference J.E. Lynch, E.L. Eliel, J. Am. Chem. Soc. 106, 2943 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3