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Hexahydro-4,7,7-trimethyl-8-(1-oxo-propyl)-trans-benzoxathiane

View entire compound with spectra: 1 NMR

Hexahydro-4,7,7-trimethyl-8-(1-oxo-propyl)-trans-benzoxathiane
SpectraBase Compound ID 6v2gAIOr7Bg
InChI InChI=1S/C14H24O2S/c1-5-11(15)13-16-12-8-9(2)6-7-10(12)14(3,4)17-13/h9-10,12-13H,5-8H2,1-4H3/t9-,10-,12-,13-/m1/s1
InChIKey AWIIKUPDFZEREE-FPQZTECRSA-N
Mol Weight 256.4 g/mol
Molecular Formula C14H24O2S
Exact Mass 256.149701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 17Z6MNwJukZ
Name Hexahydro-4,7,7-trimethyl-8-(1-oxo-propyl)-trans-benzoxathiane
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H24O2S
InChI InChI=1S/C14H24O2S/c1-5-11(15)13-16-12-8-9(2)6-7-10(12)14(3,4)17-13/h9-10,12-13H,5-8H2,1-4H3/t9-,10-,12-,13-/m1/s1
InChIKey AWIIKUPDFZEREE-FPQZTECRSA-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