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2-(4-Hydroxyphenyloxysulfonyl)-13,13,14,14-tetracyanoanthraquinodimethane
SpectraBase Compound ID LYf1T6D75a6
InChI InChI=1S/C26H12N4O4S/c27-12-16(13-28)25-21-3-1-2-4-22(21)26(17(14-29)15-30)24-11-20(9-10-23(24)25)35(32,33)34-19-7-5-18(31)6-8-19/h1-11,31H
InChIKey RHFBLFKOCYIRIN-UHFFFAOYSA-N
Mol Weight 476.47 g/mol
Molecular Formula C26H12N4O4S
Exact Mass 476.057926 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7WdgqK4ngJ4
Name 2-(4-HYDROXYPHENYLOXYSULFONYL)-13,13,14,14-TETRACYANO-ANTHRAQUINO-DIMETHANE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H12N4O4S
InChI InChI=1S/C26H12N4O4S/c27-12-16(13-28)25-21-3-1-2-4-22(21)26(17(14-29)15-30)24-11-20(9-10-23(24)25)35(32,33)34-19-7-5-18(31)6-8-19/h1-11,31H
InChIKey RHFBLFKOCYIRIN-UHFFFAOYSA-N
Literature Reference Author D.F.PEREPICHKA,M.R.BRYCE,A.S.BATSANOV,J.A.K.HOWARD,A.O.CUELL O,M.GRAY,V.M.ROTELLO
Literature Reference Citation J.ORG.CHEM.,66,4517(2001)
Literature Reference DOI 10.1021/jo001576+
Molecular Weight 476.466 g/mol
Solvent ACETONE-D6
Source File Reference UWMS28033