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undecane-4,5-diylbis(methylsulfane)
SpectraBase Compound ID 1wWHly3kYnB
InChI InChI=1S/C13H28S2/c1-5-7-8-9-11-13(15-4)12(14-3)10-6-2/h12-13H,5-11H2,1-4H3
InChIKey KWRDDZCEOCSNHV-UHFFFAOYSA-N
Mol Weight 248.49 g/mol
Molecular Formula C13H28S2
Exact Mass 248.163243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mlqGHeKHw
Name undecane-4,5-diylbis(methylsulfane)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H28S2
InChI InChI=1S/C13H28S2/c1-5-7-8-9-11-13(15-4)12(14-3)10-6-2/h12-13H,5-11H2,1-4H3
InChIKey KWRDDZCEOCSNHV-UHFFFAOYSA-N
Instrument Name Shimadzu 2010-QP2010 Plus
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202000483
Molecular Weight 248.487 g/mol
SMILES CCCCCCC(C(SC)CCC)SC
SPLASH splash10-01ot-9400000000-c80a2d1154fd45def82f
Source of Spectrum CBD-17-3-Figure 4-2
Wiley ID 1855887