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5-HEXADECYL-4-HYDROXY-3,5-DIMETHYL-2(5H)-THIOPHENONE
SpectraBase Compound ID FRSVRJUxeNq
InChI InChI=1S/C22H40O2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(3)20(23)19(2)21(24)25-22/h23H,4-18H2,1-3H3
InChIKey RABWNOXOIDGJPF-UHFFFAOYSA-N
Mol Weight 368.6 g/mol
Molecular Formula C22H40O2S
Exact Mass 368.274902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LrUXxtW81mG
Name 5-HEXADECYL-4-HYDROXY-3,5-DIMETHYL-2(5H)-THIOPHENONE
Compound Number 7E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H40O2S
InChI InChI=1S/C22H40O2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(3)20(23)19(2)21(24)25-22/h23H,4-18H2,1-3H3
InChIKey RABWNOXOIDGJPF-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 368.618 g/mol
Solvent CDCl3
Source File Reference UWMB1327