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2Sqdx13l65I
spectrumID
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2Sqdx13l65I
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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(E)-2-(2,6-DIMETHYL-1,5-HEPTADIENYL)-m-DITHIANE
SpectraBase Compound ID FySEX5kyVr9
InChI InChI=1S/C13H22S2/c1-11(2)6-4-7-12(3)10-13-14-8-5-9-15-13/h6,10,13H,4-5,7-9H2,1-3H3
InChIKey RBHYZSIGEPLTPA-UHFFFAOYSA-N
Mol Weight 242.44 g/mol
Molecular Formula C13H22S2
Exact Mass 242.116293 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Sqdx13l65I
Name (E)-2-(2,6-DIMETHYL-1,5-HEPTADIENYL)-m-DITHIANE
Source of Sample A. Hoppmann, P. Weyerstahl Liebigs Ann. Chem. 1977, 1547
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22S2
InChI InChI=1S/C13H22S2/c1-11(2)6-4-7-12(3)10-13-14-8-5-9-15-13/h6,10,13H,4-5,7-9H2,1-3H3
InChIKey RBHYZSIGEPLTPA-UHFFFAOYSA-N
Molecular Weight 242.45
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian CFT-20
Synonyms M-DITHIANE, 2-/2,6-DIMETHYL- 1,5-HEPTADIENYL/-, /E/-,
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