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(S)-1,1-DIMETHYLETHYL-3-HYDROXY-2-METHYL-3-PHENYLPROPANETHIOATE
SpectraBase Compound ID Azvq0cmFns
InChI InChI=1S/C14H20O2S/c1-10(13(16)17-14(2,3)4)12(15)11-8-6-5-7-9-11/h5-10,12,15H,1-4H3/t10-,12-/m0/s1
InChIKey LBHDIVBTIRAPJX-JQWIXIFHSA-N
Mol Weight 252.37 g/mol
Molecular Formula C14H20O2S
Exact Mass 252.118401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 88vu1TxNxah
Name (S)-1,1-DIMETHYLETHYL-3-HYDROXY-2-METHYL-3-PHENYLPROPANETHIOATE
Compound Number 26A-SYN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20O2S
InChI InChI=1S/C14H20O2S/c1-10(13(16)17-14(2,3)4)12(15)11-8-6-5-7-9-11/h5-10,12,15H,1-4H3/t10-,12-/m0/s1
InChIKey LBHDIVBTIRAPJX-JQWIXIFHSA-N
Literature Reference Author S.E.DENMARK,B.D.GRIEDEL,D.M.COE,M.E.SCHNUTE
Literature Reference Citation J.AM.CHEM.SOC.,116,7026(1994)
Literature Reference DOI 10.1021/ja00095a004
Molecular Weight 252.372 g/mol
Solvent Unknown
Source File Reference UWSI699