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benzoic acid, 4-[[[2,3-dihydro-2-(4-nitrophenyl)-1,3-dioxo-1H-isoindol-5-yl]carbonyl]amino]-, methyl ester
SpectraBase Compound ID JPYpf02YW0O
InChI InChI=1S/C23H15N3O7/c1-33-23(30)13-2-5-15(6-3-13)24-20(27)14-4-11-18-19(12-14)22(29)25(21(18)28)16-7-9-17(10-8-16)26(31)32/h2-12H,1H3,(H,24,27)
InChIKey QTEKJJCGXRXMBB-UHFFFAOYSA-N
Mol Weight 445.39 g/mol
Molecular Formula C23H15N3O7
Exact Mass 445.091 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BCguP209KGA
Name benzoic acid, 4-[[[2,3-dihydro-2-(4-nitrophenyl)-1,3-dioxo-1H-isoindol-5-yl]carbonyl]amino]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 445.090999828 u
Formula C23H15N3O7
InChI InChI=1S/C23H15N3O7/c1-33-23(30)13-2-5-15(6-3-13)24-20(27)14-4-11-18-19(12-14)22(29)25(21(18)28)16-7-9-17(10-8-16)26(31)32/h2-12H,1H3,(H,24,27)
InChIKey QTEKJJCGXRXMBB-UHFFFAOYSA-N
Molecular Weight 445.387 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9600
Solvent DMSO-d6
Source Vendor ID: NMR/10240612; Lab Info: AI; Lab Number: AI-S001254
Temperature 29.85 °C