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2-[5-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-furyl]benzoic acid
SpectraBase Compound ID 1d27vs2ZNCa
InChI InChI=1S/C28H28O6/c1-27(2)11-17(29)23-21(13-27)34-22-14-28(3,4)12-18(30)24(22)25(23)20-10-9-19(33-20)15-7-5-6-8-16(15)26(31)32/h5-10,25H,11-14H2,1-4H3,(H,31,32)
InChIKey BEKBMAZMNMSQIS-UHFFFAOYSA-N
Mol Weight 460.53 g/mol
Molecular Formula C28H28O6
Exact Mass 460.188589 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cis5AcCmWRU
Name 2-[5-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-furyl]benzoic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C28H28O6/c1-27(2)11-17(29)23-21(13-27)34-22-14-28(3,4)12-18(30)24(22)25(23)20-10-9-19(33-20)15-7-5-6-8-16(15)26(31)32/h5-10,25H,11-14H2,1-4H3,(H,31,32)
InChIKey BEKBMAZMNMSQIS-UHFFFAOYSA-N
NMR Offset 16.1752
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_ASIOH_7529_44
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/8033171; Labnumber: SAD-9830245
Temperature 313 °C