For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-Methyl-benzoic acid 2-(4-nitro-phenyl)-2-oxo-ethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-Methyl-benzoic acid 2-(4-nitro-phenyl)-2-oxo-ethyl ester
SpectraBase Compound ID 1IGm1toy32H
InChI InChI=1S/C16H13NO5/c1-11-2-4-13(5-3-11)16(19)22-10-15(18)12-6-8-14(9-7-12)17(20)21/h2-9H,10H2,1H3
InChIKey ZNXHDLFRGPOSMA-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

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2Ubrhn48ooL
Name benzoic acid, 4-methyl-, 2-(4-nitrophenyl)-2-oxoethyl 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/c1-11-2-4-13(5-3-11)16(19)22-10-15(18)12-6-8-14(9-7-12)17(20)21/h2-9H,10H2,1H3
InChIKey ZNXHDLFRGPOSMA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_4504
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-205/5068772; Labnumber: AI-10301; IOH_ID: IOH-011507