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R-2-PHENYL-TRANS-4,TRANS-6-DIMETHYL-1,3-DITHIANE
SpectraBase Compound ID 5Kv5kSTb2CO
InChI InChI=1S/C12H16S2/c1-9-8-10(2)14-12(13-9)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t9-,10+,12+
InChIKey HPIUOJZLYNYVEM-IAZYJMLFSA-N
Mol Weight 224.38 g/mol
Molecular Formula C12H16S2
Exact Mass 224.069343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2csqPkUfeZl
Name 4,6-DIMETHYL-2-BETA-PHENYL-1,3-DITHIANE
Compound Number 2-P H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16S2
InChI InChI=1S/C12H16S2/c1-9-8-10(2)14-12(13-9)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t9-,10+,12+
InChIKey HPIUOJZLYNYVEM-IAZYJMLFSA-N
Literature Reference Author A.TOUTCHKINE,E.L.CLENNAN
Literature Reference Citation J.ORG.CHEM.,64,5620(1999)
Literature Reference DOI 10.1021/jo990709s
Molecular Weight 224.379 g/mol
Sample ID 40149
Solvent CDCl3