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benzoic acid, 3-[[[2-[4-(ethoxycarbonyl)phenyl]-2,3-dihydro-1,3-dioxo-1H-isoindol-5-yl]carbonyl]amino]-
SpectraBase Compound ID 1i9sfEqYHFr
InChI InChI=1S/C25H18N2O7/c1-2-34-25(33)14-6-9-18(10-7-14)27-22(29)19-11-8-15(13-20(19)23(27)30)21(28)26-17-5-3-4-16(12-17)24(31)32/h3-13H,2H2,1H3,(H,26,28)(H,31,32)
InChIKey FRXMEEUTPRVZSH-UHFFFAOYSA-N
Mol Weight 458.43 g/mol
Molecular Formula C25H18N2O7
Exact Mass 458.111401 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DLlGPF8zO6X
Name benzoic acid, 3-[[[2-[4-(ethoxycarbonyl)phenyl]-2,3-dihydro-1,3-dioxo-1H-isoindol-5-yl]carbonyl]amino]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.111400921 u
Formula C25H18N2O7
InChI InChI=1S/C25H18N2O7/c1-2-34-25(33)14-6-9-18(10-7-14)27-22(29)19-11-8-15(13-20(19)23(27)30)21(28)26-17-5-3-4-16(12-17)24(31)32/h3-13H,2H2,1H3,(H,26,28)(H,31,32)
InChIKey FRXMEEUTPRVZSH-UHFFFAOYSA-N
Molecular Weight 458.426 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5791
Solvent DMSO-d6
Source Vendor ID: NMR/9254727; Lab Info: AI; Lab Number: AI-S000763