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2-({[1,3-dioxo-2-(2-pyridinyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)benzoic acid
SpectraBase Compound ID 1NATU9Om4y2
InChI InChI=1S/C21H13N3O5/c25-18(23-16-6-2-1-5-14(16)21(28)29)12-8-9-13-15(11-12)20(27)24(19(13)26)17-7-3-4-10-22-17/h1-11H,(H,23,25)(H,28,29)
InChIKey KVLFEZSMBHKJHH-UHFFFAOYSA-N
Mol Weight 387.35 g/mol
Molecular Formula C21H13N3O5
Exact Mass 387.085521 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LWF2jTAUF5
Name 2-({[1,3-dioxo-2-(2-pyridinyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)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/C21H13N3O5/c25-18(23-16-6-2-1-5-14(16)21(28)29)12-8-9-13-15(11-12)20(27)24(19(13)26)17-7-3-4-10-22-17/h1-11H,(H,23,25)(H,28,29)
InChIKey KVLFEZSMBHKJHH-UHFFFAOYSA-N
NMR Offset 17.5286
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_3855
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/6049918; Labnumber: LN-1156; IOH_ID: IOH-003856
Temperature 313 °C