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2,4-DIMETHYL-3-HYDROXY-5-(BUTYLTHIO)-PENTANOIC-ACID-S-(1,1-DIMETHYLETHYL)-THIOESTER
SpectraBase Compound ID gJAxXxoWlV
InChI InChI=1S/C15H30O2S2/c1-7-8-9-18-10-11(2)13(16)12(3)14(17)19-15(4,5)6/h11-13,16H,7-10H2,1-6H3/t11-,12+,13-/m1/s1
InChIKey RCTYRCLFZPRVDR-FRRDWIJNSA-N
Mol Weight 306.52 g/mol
Molecular Formula C15H30O2S2
Exact Mass 306.168723 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KS8YpjJozz7
Name 2,4-DIMETHYL-3-HYDROXY-5-(BUTYLTHIO)-PENTANOIC-ACID-S-(1,1-DIMETHYLETHYL)-THIOESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H30O2S2
InChI InChI=1S/C15H30O2S2/c1-7-8-9-18-10-11(2)13(16)12(3)14(17)19-15(4,5)6/h11-13,16H,7-10H2,1-6H3/t11-,12+,13-/m1/s1
InChIKey RCTYRCLFZPRVDR-FRRDWIJNSA-N
Literature Reference Author R.ANNUNZIATA,M.CINQUINI,F.COZZI,P.G.COZZI,E.CONSOLANDI
Literature Reference Citation J.ORG.CHEM.,57,456(1992)
Literature Reference DOI 10.1021/jo00028a015
Molecular Weight 306.522 g/mol
Solvent CDCl3
Source File Reference UWCS2106