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1,3-benzodioxole-5-carboxylic acid, (2Z)-2-[[4-(1,1-dimethylethyl)phenyl]methylene]-2,3-dihydro-3-oxobenzofuranyl ester
SpectraBase Compound ID E8OX89ItvcA
InChI InChI=1S/C27H22O6/c1-27(2,3)18-7-4-16(5-8-18)12-24-25(28)20-10-9-19(14-22(20)33-24)32-26(29)17-6-11-21-23(13-17)31-15-30-21/h4-14H,15H2,1-3H3/b24-12-
InChIKey GYLYNPFQYSJXBG-MSXFZWOLSA-N
Mol Weight 442.47 g/mol
Molecular Formula C27H22O6
Exact Mass 442.141638 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KBhyV6M0YMM
Name 1,3-benzodioxole-5-carboxylic acid, (2Z)-2-[[4-(1,1-dimethylethyl)phenyl]methylene]-2,3-dihydro-3-oxobenzofuranyl ester
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/C27H22O6/c1-27(2,3)18-7-4-16(5-8-18)12-24-25(28)20-10-9-19(14-22(20)33-24)32-26(29)17-6-11-21-23(13-17)31-15-30-21/h4-14H,15H2,1-3H3/b24-12-
InChIKey GYLYNPFQYSJXBG-MSXFZWOLSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1976
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: F13808; Labnumber: ExLab-N0201-0905