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2-bromo-4-(1,3-dithiolan-2-yl)-6-methoxyphenol, p-toluenesulfonate
SpectraBase Compound ID CIl1zxhjz1z
InChI InChI=1S/C17H17BrO4S3/c1-11-3-5-13(6-4-11)25(19,20)22-16-14(18)9-12(10-15(16)21-2)17-23-7-8-24-17/h3-6,9-10,17H,7-8H2,1-2H3
InChIKey QQRUHTNSJZVPNA-UHFFFAOYSA-N
Mol Weight 461.4 g/mol
Molecular Formula C17H17BrO4S3
Exact Mass 459.947236 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ByDJMMiMDVQ
Name 2-BROMO-4-(1,3-DITHIOLAN-2-YL)-6-METHOXYPHENOL, p-TOLUENESULFONATE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17BrO4S3
InChI InChI=1S/C17H17BrO4S3/c1-11-3-5-13(6-4-11)25(19,20)22-16-14(18)9-12(10-15(16)21-2)17-23-7-8-24-17/h3-6,9-10,17H,7-8H2,1-2H3
InChIKey QQRUHTNSJZVPNA-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 139-140C
Molecular Weight 461.42
Solvent CDCl3; Reference=TMS; Temperature 297K