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(1S,2R)-2-METHYL-1-PHENYL-3-(4-METHYLPHENYLSULFINYL)-2-TRIDEUTERIOMETHYL-3-BUTEN-1-OL
SpectraBase Compound ID Ibkyi8CBsr6
InChI InChI=1S/C19H22O2S/c1-14-10-12-17(13-11-14)22(21)15(2)19(3,4)18(20)16-8-6-5-7-9-16/h5-13,18,20H,2H2,1,3-4H3/t18-,22?/m0/s1/i3D3/t18-,19?,22?
InChIKey FUFYNHPYFDZGRF-PTKIJMMESA-N
Mol Weight 317.46 g/mol
Molecular Formula C19H192H3O2S
Exact Mass 317.152881 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cvb3Up8kzw2
Name (1S,2R)-2-METHYL-1-PHENYL-3-(4-METHYLPHENYLSULFINYL)-2-TRIDEUTERIOMETHYL-3-BUTEN-1-OL
Compound Number 7K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H192H3O2S
InChI InChI=1S/C19H22O2S/c1-14-10-12-17(13-11-14)22(21)15(2)19(3,4)18(20)16-8-6-5-7-9-16/h5-13,18,20H,2H2,1,3-4H3/t18-,22?/m0/s1/i3D3/t18-,19?,22?
InChIKey FUFYNHPYFDZGRF-PTKIJMMESA-N
Literature Reference Author G.SKLUTE,D.AMSALLEM,A.SHABLI,J.P.VARGHESE,I.MAREK
Literature Reference Citation J.AM.CHEM.SOC.,125,11776(2003)
Literature Reference DOI 10.1021/ja036872t
Molecular Weight 317.461 g/mol
Sample ID 50592
Solvent CDCl3