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4-nitro-m-toluic acid, ester with 2-hydoxyacetophenone

View entire compound with spectra: 3 NMR, 1 FTIR, 1 UV-Vis, and 1 MS (GC)

4-nitro-m-toluic acid, ester with 2-hydoxyacetophenone
SpectraBase Compound ID 2TkOlJ5tCj9
InChI InChI=1S/C16H13NO5/c1-11-9-13(7-8-14(11)17(20)21)16(19)22-10-15(18)12-5-3-2-4-6-12/h2-9H,10H2,1H3
InChIKey HLJUZHBJHDGFSJ-UHFFFAOYSA-N
Mol Weight 299.28 g/mol
Molecular Formula C16H13NO5
Exact Mass 299.079373 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4wwtV6NVjiQ
Name benzoic acid, 3-methyl-4-nitro-, 2-oxo-2-phenylethyl 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/C16H13NO5/c1-11-9-13(7-8-14(11)17(20)21)16(19)22-10-15(18)12-5-3-2-4-6-12/h2-9H,10H2,1H3
InChIKey HLJUZHBJHDGFSJ-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_3491
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: NMR/10228172