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2-Sulfo-1,3-xylyl-27-crown-8
SpectraBase Compound ID EfUymS2aH93
InChI InChI=1S/C22H36O11S/c23-34(24,25)22-20-2-1-3-21(22)19-33-17-15-31-13-11-29-9-7-27-5-4-26-6-8-28-10-12-30-14-16-32-18-20/h1-3H,4-19H2,(H,23,24,25)
InChIKey PDIVINXCCULMJI-UHFFFAOYSA-N
Mol Weight 508.6 g/mol
Molecular Formula C22H36O11S
Exact Mass 508.197833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AyOwtt7kUUO
Name 2-Sulfo-1,3-xylyl-27-crown-8
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C22H36O11S
InChI InChI=1S/C22H36O11S/c23-34(24,25)22-20-2-1-3-21(22)19-33-17-15-31-13-11-29-9-7-27-5-4-26-6-8-28-10-12-30-14-16-32-18-20/h1-3H,4-19H2,(H,23,24,25)
InChIKey PDIVINXCCULMJI-UHFFFAOYSA-N
Instrument Name SF = 200 MHz
Literature Reference J. Van Eerden, M. Skowronska-Ptasinska, J. Am. Chem. Soc. 111, 700 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3