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4(S),5(S)-4-[[6,6-(2)H(2)]-6-HYDROXYHEXYL-1-((1-METHYLETHYL)-THIO)]-5-[(2)H(3)]-METHYL-IMIDAZOLIDIN-2-ONE
SpectraBase Compound ID ER4GlldTDZ7
InChI InChI=1S/C13H26N2O2S/c1-9(2)18-11(7-5-4-6-8-16)12-10(3)14-13(17)15-12/h9-12,16H,4-8H2,1-3H3,(H2,14,15,17)
InChIKey HLPNOKWWQNCYPS-UHFFFAOYSA-N
Mol Weight 274.42 g/mol
Molecular Formula C13H26N2O2S
Exact Mass 274.171499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2DUG1c5X9On
Name 4(S),5(S)-4-[[6,6-(2)H(2)]-6-HYDROXYHEXYL-1-((1-METHYLETHYL)-THIO)]-5-[(2)H(3)]-METHYL-IMIDAZOLIDIN-2-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H26N2O2S
InChI InChI=1S/C13H26N2O2S/c1-9(2)18-11(7-5-4-6-8-16)12-10(3)14-13(17)15-12/h9-12,16H,4-8H2,1-3H3,(H2,14,15,17)
InChIKey HLPNOKWWQNCYPS-UHFFFAOYSA-N
Literature Reference Author F.ESCALETTES,D.FLORENTIN,B.T.S.BUI,D.LESAGE,A.MARQUET
Literature Reference Citation J.AM.CHEM.SOC.,121,3571(1999)
Literature Reference DOI 10.1021/ja9811748
Molecular Weight 274.422 g/mol
Solvent ACETONE-D6
Source File Reference UWRU10896