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XHRMHXUUUXWHOY-ZSCHJXSPSA-N

View entire compound with spectra: 1 NMR

XHRMHXUUUXWHOY-ZSCHJXSPSA-N
SpectraBase Compound ID 6K2Lcnxc7c1
InChI InChI=1S/C12H24S4.C6H9NO2/c1-5-13-7-2-9-15-11-4-12-16-10-3-8-14-6-1;1-5(3-4-7)9-6(2)8/h1-12H2;5H,3H2,1-2H3/t;5-/m.0/s1
InChIKey XHRMHXUUUXWHOY-ZSCHJXSPSA-N
Mol Weight 423.7 g/mol
Molecular Formula C18H33NO2S4
Exact Mass 423.139414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Tvqs0EiJO5
Name XHRMHXUUUXWHOY-ZSCHJXSPSA-N
Compound Number 1/24
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H33NO2S4
InChI InChI=1S/C12H24S4.C6H9NO2/c1-5-13-7-2-9-15-11-4-12-16-10-3-8-14-6-1;1-5(3-4-7)9-6(2)8/h1-12H2;5H,3H2,1-2H3/t;5-/m.0/s1
InChIKey XHRMHXUUUXWHOY-ZSCHJXSPSA-N
Literature Reference Author T.ITOH,Y.TAKAGI,T.MURAKAMI,Y.HIYAMA,H.TSUKUBE
Literature Reference Citation J.ORG.CHEM.,61,2158(1996)
Literature Reference DOI 10.1021/jo951598+
Molecular Weight 423.706 g/mol
Solvent CDCl3;2-EQUIVALENTS-CROWN-ETHER