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benzoic acid, 2-(acetylamino)-3-methyl-5-nitro-, methyl ester
SpectraBase Compound ID 6CYQ08r1AbD
InChI InChI=1S/C11H12N2O5/c1-6-4-8(13(16)17)5-9(11(15)18-3)10(6)12-7(2)14/h4-5H,1-3H3,(H,12,14)
InChIKey CTRBXYMUCRFWGM-UHFFFAOYSA-N
Mol Weight 252.23 g/mol
Molecular Formula C11H12N2O5
Exact Mass 252.074621 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GKxAv8AyabZ
Name benzoic acid, 2-(acetylamino)-3-methyl-5-nitro-, methyl 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/C11H12N2O5/c1-6-4-8(13(16)17)5-9(11(15)18-3)10(6)12-7(2)14/h4-5H,1-3H3,(H,12,14)
InChIKey CTRBXYMUCRFWGM-UHFFFAOYSA-N
NMR Offset 17.7627
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Origin 1H_ASIOH_8516_8311
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: ZERO/005558; IOH_ID: IOH-015316