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Pentaerythritol tetrakis(benzenesulfonate)

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Pentaerythritol tetrakis(benzenesulfonate)
SpectraBase Compound ID 85VWzAnFwAp
InChI InChI=1S/C29H28O12S4/c30-42(31,25-13-5-1-6-14-25)38-21-29(22-39-43(32,33)26-15-7-2-8-16-26,23-40-44(34,35)27-17-9-3-10-18-27)24-41-45(36,37)28-19-11-4-12-20-28/h1-20H,21-24H2
InChIKey USQQFBRJEIDVBV-UHFFFAOYSA-N
Mol Weight 696.8 g/mol
Molecular Formula C29H28O12S4
Exact Mass 696.046361 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IpQD56TSNya
Name PENTAERYTHRITOL, TETRAKIS(BENZENESULFONATE)
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H28O12S4
InChI InChI=1S/C29H28O12S4/c30-42(31,25-13-5-1-6-14-25)38-21-29(22-39-43(32,33)26-15-7-2-8-16-26,23-40-44(34,35)27-17-9-3-10-18-27)24-41-45(36,37)28-19-11-4-12-20-28/h1-20H,21-24H2
InChIKey USQQFBRJEIDVBV-UHFFFAOYSA-N
Molecular Weight 696.80
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PENTAERYTHRITOL, TETRABENZENESULFONATE