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4-hydroxythio-3,5-xylenesulfonic acid, s-4-hydroxy-3,5-xylyl ester, diacetate
SpectraBase Compound ID 5pzaaVFn8jT
InChI InChI=1S/C20H22O6S2/c1-11-7-17(8-12(2)19(11)25-15(5)21)27-28(23,24)18-9-13(3)20(14(4)10-18)26-16(6)22/h7-10H,1-6H3
InChIKey VZDNLDGMILMKDY-UHFFFAOYSA-N
Mol Weight 422.51 g/mol
Molecular Formula C20H22O6S2
Exact Mass 422.085781 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 86DUpL5auCE
Name 4-hydroxythio-3,5-xylenesulfonic acid, s-4-hydroxy-3,5-xylyl ester, diacetate
Source of Sample H. H. Takimoto, Aerospace Corporation, Los Angeles, California
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O6S2
InChI InChI=1S/C20H22O6S2/c1-11-7-17(8-12(2)19(11)25-15(5)21)27-28(23,24)18-9-13(3)20(14(4)10-18)26-16(6)22/h7-10H,1-6H3
InChIKey VZDNLDGMILMKDY-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference JOCE 29, 759(1964)
Sadtler NMR Number 1156M
Solvent TFA
Synonyms 3,5-XYLENESULFONIC ACID, 4-HYDROXY- THIO-, S-4-HYDROXY-3,5-XYLYL ESTER, DIACETATE