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(S)-1,1-DIMETHYLETHYL-3-HYDROXY-2-METHYL-5-PHENYL-4-PENTENETHIOATE
SpectraBase Compound ID LRSnnmDhtZk
InChI InChI=1S/C16H22O2S/c1-12(15(18)19-16(2,3)4)14(17)11-10-13-8-6-5-7-9-13/h5-12,14,17H,1-4H3/b11-10+/t12-,14+/m0/s1
InChIKey PIZSXQFDKPYHBF-XVQHWYGASA-N
Mol Weight 278.41 g/mol
Molecular Formula C16H22O2S
Exact Mass 278.134051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1OvuFz8lWjc
Name (S)-1,1-DIMETHYLETHYL-3-HYDROXY-2-METHYL-5-PHENYL-4-PENTENETHIOATE
Compound Number 26B-SYN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22O2S
InChI InChI=1S/C16H22O2S/c1-12(15(18)19-16(2,3)4)14(17)11-10-13-8-6-5-7-9-13/h5-12,14,17H,1-4H3/b11-10+/t12-,14+/m0/s1
InChIKey PIZSXQFDKPYHBF-XVQHWYGASA-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 278.409 g/mol
Solvent Unknown
Source File Reference UWSI700