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3-nitrobenzyl 4-methyl-3-(4-methyl-1,3-dioxo-1,3-dihydro-2H-pyrrolo[3,4-c]quinolin-2-yl)benzoate
SpectraBase Compound ID 2qEJaRKJaaA
InChI InChI=1S/C27H19N3O6/c1-15-10-11-18(27(33)36-14-17-6-5-7-19(12-17)30(34)35)13-22(15)29-25(31)23-16(2)28-21-9-4-3-8-20(21)24(23)26(29)32/h3-13H,14H2,1-2H3
InChIKey IRGMPHJOFPMHKL-UHFFFAOYSA-N
Mol Weight 481.46 g/mol
Molecular Formula C27H19N3O6
Exact Mass 481.127385 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID RgOybj6xmo
Name 3-nitrobenzyl 4-methyl-3-(4-methyl-1,3-dioxo-1,3-dihydro-2H-pyrrolo[3,4-c]quinolin-2-yl)benzoate
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/C27H19N3O6/c1-15-10-11-18(27(33)36-14-17-6-5-7-19(12-17)30(34)35)13-22(15)29-25(31)23-16(2)28-21-9-4-3-8-20(21)24(23)26(29)32/h3-13H,14H2,1-2H3
InChIKey IRGMPHJOFPMHKL-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23071
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: D37083; Labnumber: RYAB2-3218; SBI_ID: SBI-023075
Temperature 306 °C