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benzoic acid, 4-(octahydro-5-methyl-1,3-dioxo-2H-isoindol-2-yl)-, 4-bromophenyl ester
SpectraBase Compound ID 62ZxQvbyGCB
InChI InChI=1S/C22H20BrNO4/c1-13-2-11-18-19(12-13)21(26)24(20(18)25)16-7-3-14(4-8-16)22(27)28-17-9-5-15(23)6-10-17/h3-10,13,18-19H,2,11-12H2,1H3
InChIKey ZOEXBLRRPBBELF-UHFFFAOYSA-N
Mol Weight 442.31 g/mol
Molecular Formula C22H20BrNO4
Exact Mass 441.057571 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AQwOFZgVkEV
Name benzoic acid, 4-(octahydro-5-methyl-1,3-dioxo-2H-isoindol-2-yl)-, 4-bromophenyl 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/C22H20BrNO4/c1-13-2-11-18-19(12-13)21(26)24(20(18)25)16-7-3-14(4-8-16)22(27)28-17-9-5-15(23)6-10-17/h3-10,13,18-19H,2,11-12H2,1H3
InChIKey ZOEXBLRRPBBELF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_8828
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: NMR/12259403