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3,5-DIMETHYL-2,4,6-TRITHIA-HEPTANE;(DIASTEREOMER-1)
SpectraBase Compound ID 6MuQo2DcO7l
InChI InChI=1S/C6H14S3/c1-5(7-3)9-6(2)8-4/h5-6H,1-4H3
InChIKey IFUYFWGLFPVEHA-UHFFFAOYSA-N
Mol Weight 182.36 g/mol
Molecular Formula C6H14S3
Exact Mass 182.025764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CntxHdaTk9D
Name 3,5-DIMETHYL-2,4,6-TRITHIA-HEPTANE;(DIASTEREOMER-1)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H14S3
InChI InChI=1S/C6H14S3/c1-5(7-3)9-6(2)8-4/h5-6H,1-4H3
InChIKey IFUYFWGLFPVEHA-UHFFFAOYSA-N
Literature Reference Author J.S.GROSSERT,D.L.HOOPER,W.M.NEAVES
Literature Reference Citation CAN.J.CHEM.,59,326(1981)
Literature Reference DOI 10.1139/v81-051
Molecular Weight 182.357 g/mol
Solvent CDCl3
Source File Reference UWED4860