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2-ALPHA,4,6-TRIMETHYL-1,3-DITHIANE

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2-ALPHA,4,6-TRIMETHYL-1,3-DITHIANE
SpectraBase Compound ID 5TISLTCgCt4
InChI InChI=1S/C7H14S2/c1-5-4-6(2)9-7(3)8-5/h5-7H,4H2,1-3H3/t5-,6+,7-
InChIKey NCICHFDJBUTJRC-KVSKUHBBSA-N
Mol Weight 162.31 g/mol
Molecular Formula C7H14S2
Exact Mass 162.053693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6NQmWVM0zSu
Name 2-ALPHA,4,6-TRIMETHYL-1,3-DITHIANE
Compound Number 1-ME
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H14S2
InChI InChI=1S/C7H14S2/c1-5-4-6(2)9-7(3)8-5/h5-7H,4H2,1-3H3/t5-,6+,7-
InChIKey NCICHFDJBUTJRC-KVSKUHBBSA-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 162.308 g/mol
Sample ID 40151
Solvent CDCl3