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1,2,3-Benzenetrithiol
SpectraBase Compound ID GXmk8a8eLLL
InChI InChI=1S/C6H6S3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H
InChIKey PPQNMKIMOCEJIR-UHFFFAOYSA-N
Mol Weight 174.29 g/mol
Molecular Formula C6H6S3
Exact Mass 173.963164 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CFBaeoxUaeA
Name 1,2,3-Benzenetrithiol
CAS Registry Number 89375-31-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6S3
InChI InChI=1S/C6H6S3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H
InChIKey PPQNMKIMOCEJIR-UHFFFAOYSA-N
Instrument Name SF = 300 MHz
Literature Reference E. Block, V. Eswarakrishnan, M. Gernon, J. Am. Chem. Soc. 111, 658 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported