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1H-isoindole-5-carboxylic acid, 2,3-dihydro-2-[4-[(3-methylbutoxy)carbonyl]phenyl]-1,3-dioxo-, methyl ester
SpectraBase Compound ID DXaYGEC8gHy
InChI InChI=1S/C22H21NO6/c1-13(2)10-11-29-22(27)14-4-7-16(8-5-14)23-19(24)17-9-6-15(21(26)28-3)12-18(17)20(23)25/h4-9,12-13H,10-11H2,1-3H3
InChIKey XRKSVVLEMBVRBL-UHFFFAOYSA-N
Mol Weight 395.41 g/mol
Molecular Formula C22H21NO6
Exact Mass 395.136887 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KyUgyLf1PUr
Name 1H-isoindole-5-carboxylic acid, 2,3-dihydro-2-[4-[(3-methylbutoxy)carbonyl]phenyl]-1,3-dioxo-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H21NO6/c1-13(2)10-11-29-22(27)14-4-7-16(8-5-14)23-19(24)17-9-6-15(21(26)28-3)12-18(17)20(23)25/h4-9,12-13H,10-11H2,1-3H3
InChIKey XRKSVVLEMBVRBL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_2375
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: AG-205/5086495; Labnumber: AI-11234; IOH_ID: IOH-009378