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RHXJOSHFFXKQKF-VWMHFEHESA-N

View entire compound with spectra: 1 NMR

RHXJOSHFFXKQKF-VWMHFEHESA-N
SpectraBase Compound ID 4ecbEMX9FdH
InChI InChI=1S/C12H24S4.C4H7NO/c1-5-13-7-2-9-15-11-4-12-16-10-3-8-14-6-1;1-4(6)2-3-5/h1-12H2;4,6H,2H2,1H3/t;4-/m.0/s1
InChIKey RHXJOSHFFXKQKF-VWMHFEHESA-N
Mol Weight 381.7 g/mol
Molecular Formula C16H31NOS4
Exact Mass 381.128849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AF71gFY83sJ
Name RHXJOSHFFXKQKF-VWMHFEHESA-N
Compound Number 2/24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H31NOS4
InChI InChI=1S/C12H24S4.C4H7NO/c1-5-13-7-2-9-15-11-4-12-16-10-3-8-14-6-1;1-4(6)2-3-5/h1-12H2;4,6H,2H2,1H3/t;4-/m.0/s1
InChIKey RHXJOSHFFXKQKF-VWMHFEHESA-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 381.668 g/mol
Solvent CDCl3;2-EQUIVALENTS-CROWN-ETHER