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benzoic acid, 4-(1,3-dihydro-4-nitro-1,3-dioxo-2H-isoindol-2-yl)-, decyl ester

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benzoic acid, 4-(1,3-dihydro-4-nitro-1,3-dioxo-2H-isoindol-2-yl)-, decyl ester
SpectraBase Compound ID 1Ps9STp4Si7
InChI InChI=1S/C25H28N2O6/c1-2-3-4-5-6-7-8-9-17-33-25(30)18-13-15-19(16-14-18)26-23(28)20-11-10-12-21(27(31)32)22(20)24(26)29/h10-16H,2-9,17H2,1H3
InChIKey UXFDPIRSAJOTSS-UHFFFAOYSA-N
Mol Weight 452.51 g/mol
Molecular Formula C25H28N2O6
Exact Mass 452.194737 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DV7lyYqOm5r
Name benzoic acid, 4-(1,3-dihydro-4-nitro-1,3-dioxo-2H-isoindol-2-yl)-, decyl 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/C25H28N2O6/c1-2-3-4-5-6-7-8-9-17-33-25(30)18-13-15-19(16-14-18)26-23(28)20-11-10-12-21(27(31)32)22(20)24(26)29/h10-16H,2-9,17H2,1H3
InChIKey UXFDPIRSAJOTSS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_4500
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: AG-205/5068722; Labnumber: AI-10287; IOH_ID: IOH-011503