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5-DECYL-5-ETHYL-4-HYDROXY-3-METHYL-2,5-DIHYDRO-2-THIOPHENE
SpectraBase Compound ID 2MF7nT3NVJa
InChI InChI=1S/C17H30O2S/c1-4-6-7-8-9-10-11-12-13-17(5-2)15(18)14(3)16(19)20-17/h18H,4-13H2,1-3H3
InChIKey UQFJBOVEOZHVIP-UHFFFAOYSA-N
Mol Weight 298.49 g/mol
Molecular Formula C17H30O2S
Exact Mass 298.196651 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D469J9HE6IP
Name 5-DECYL-5-ETHYL-4-HYDROXY-3-METHYL-2,5-DIHYDRO-2-THIOPHENE
Compound Number 12A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H30O2S
InChI InChI=1S/C17H30O2S/c1-4-6-7-8-9-10-11-12-13-17(5-2)15(18)14(3)16(19)20-17/h18H,4-13H2,1-3H3
InChIKey UQFJBOVEOZHVIP-UHFFFAOYSA-N
Literature Reference Author S.M.JONES,J.E.URCH,R.BRUN,J.L.HARWOOD,C.BERRY,I.H.GILBERT
Literature Reference Citation BIOORG.MED.CHEM.,12,683(2004)
Molecular Weight 298.484 g/mol
Solvent CDCl3
Source File Reference UWMB1334