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Octakis(pentylthio)-naphthalene
SpectraBase Compound ID 1EPuOMmaCPY
InChI InChI=1S/C50H88S8/c1-9-17-25-33-51-43-41-42(45(53-35-27-19-11-3)48(56-38-30-22-14-6)47(43)55-37-29-21-13-5)46(54-36-28-20-12-4)50(58-40-32-24-16-8)49(57-39-31-23-15-7)44(41)52-34-26-18-10-2/h9-40H2,1-8H3
InChIKey DMAFDQLDVCPIIT-UHFFFAOYSA-N
Mol Weight 945.7 g/mol
Molecular Formula C50H88S8
Exact Mass 944.465172 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DSmxtgcYx7g
Name Octakis(pentylthio)-naphthalene
CAS Registry Number 88977-47-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C50H88S8
InChI InChI=1S/C50H88S8/c1-9-17-25-33-51-43-41-42(45(53-35-27-19-11-3)48(56-38-30-22-14-6)47(43)55-37-29-21-13-5)46(54-36-28-20-12-4)50(58-40-32-24-16-8)49(57-39-31-23-15-7)44(41)52-34-26-18-10-2/h9-40H2,1-8H3
InChIKey DMAFDQLDVCPIIT-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference W. Poules, K. Praefcke, Chemiker-Zeitung 107, 373 (1983).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3