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1-(4-Nitrophenyl)ethanone

Compound with spectra: 25 NMR, 8 FTIR, 2 Raman, 1 UV-Vis, and 16 MS (GC)

1-(4-Nitrophenyl)ethanone
SpectraBase Compound ID 1rlc0ZIcjbN
InChI InChI=1S/C8H7NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3
InChIKey YQYGPGKTNQNXMH-UHFFFAOYSA-N
Mol Weight 165.15 g/mol
Molecular Formula C8H7NO3
Exact Mass 165.042593 g/mol

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FTIR Spectrum
Copyright Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved.
Technique KBr-Pellet

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FTIR Spectrum
Copyright Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company Llc.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number N9608
Technique KBr0

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FTIR Spectrum
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number N9608
Technique Mull

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MS (GC) Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany

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MS (GC) Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany

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MS (GC) Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany

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MS (GC) Spectrum
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS

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MS (GC) Spectrum
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AA-0-1071-2

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum HE-1982-0-0

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MS (GC) Spectrum
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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum ACI-57-SM11-4g (DOI: 10.1002/anie.201710370)

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum ACI-61-SM22-Figure S13b (DOI: 10.1002/anie.202116623)

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MS (GC) Spectrum
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Source of Spectrum SO-0-1139-0

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MS (GC) Spectrum
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Source of Spectrum SRH-2022-1658-0

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MS (GC) Spectrum
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Source of Spectrum SO-0-2026-0

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MS (GC) Spectrum
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Source of Spectrum OS-5-367-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum J-80-7881-3q

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13C NMR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample MCB Manufacturing Chemists, Norwood, Ohio
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3

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13C NMR Spectrum
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Solvent NT

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13C NMR Spectrum
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Solvent CHCl2F

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13C NMR Spectrum
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Solvent Neat liquid

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13C NMR Spectrum
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Solvent CDCl3

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13C NMR Spectrum
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Solvent CHCl2F

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13C NMR Spectrum
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Solvent Neat liquid

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13C NMR Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
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Solvent CHCl2F

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13C NMR Spectrum
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Solvent Neat liquid

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13C NMR Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent SOLIDSTATE

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13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6

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13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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1H NMR Spectrum
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample The Matheson Company, Inc., East Rutherford, New Jersey
Solvent CDCl3

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1H NMR Spectrum
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

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17O NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CH3CN

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17O NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE

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17O NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DIOXANE

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17O NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent NEAT

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17O NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CH3CN

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17O NMR Spectrum
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Solvent Neat liquid

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17O NMR Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Solvent Acetone

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17O NMR Spectrum
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Solvent Dioxane

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17O NMR Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Solvent Neat liquid

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Raman Spectrum
Copyright Copyright © 2014-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company Llc.
Source of Spectrum Bio-Rad Laboratories
Catalog Number N9608

View Spectrum of 1-(4-Nitrophenyl)ethanone

Raman Spectrum
Copyright Copyright © 2014-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Spectrochem Pvt. Ltd., India
Source of Spectrum Bio-Rad Laboratories
Catalog Number 11451

View Spectrum of 1-(4-Nitrophenyl)ethanone

ATR-IR Spectrum
Copyright Copyright © 2014-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company Llc.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number N9608

View Spectrum of 1-(4-Nitrophenyl)ethanone

ATR-IR Spectrum
Copyright Copyright © 2014-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Spectrochem Pvt. Ltd.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number 11451

View Spectrum of 1-(4-Nitrophenyl)ethanone

ATR-IR Spectrum
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number N9608

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UV-Vis Spectrum
Copyright Copyright © 2008-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol

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Vapor Phase IR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.

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Vapor Phase IR Spectrum
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number N9608
  • 4'-Nitroacetophenone
  • p-Nitroacetophenone
  • 4-Acetylnitrobenzene
  • p-Nitrophenyl methyl ketone
  • PNAP
  • Methyl 4-nitrophenyl ketone
  • 4-Nitroacetophenone
  • 4-Nitroacetophenone, 1-(4-nitrophenyl)ethanone
  • Ethanone, 1-(4-nitrophenyl)-
  • Paranitroacetophenone
  • p-Acetylnitrobenzene
  • Acetophenone, 4'-nitro-
  • 1-Acetyl-4-nitrobenzene
  • Methyl-p-nitrophenyl ketone
  • CCRIS 1676
  • EINECS 202-827-4
  • NSC 41590
  • AI3-19032
  • Acetophenone,4-nitro-
  • 1-(4-nitrophenyl)ethan-1-one
JXMYUMNAEKRMIP-UHFFFAOYSA-N
1-tert-Butyl-4-nitrobenzene
1-(2-Methylpropyl)-4-nitrobenzene
3-(4-Nitrophenyl)-1-propanol
1-Butyl-4-nitrobenzene
1-nitro-4-(prop-1-yn-1-yl)benzene
1-Nitro-4-(trifluoromethyl)benzene
1-(4-Azidophenyl)ethanone
1-(but-3-en-1-yn-1-yl)-4-nitrobenzene
Poly(iminopentamethylenecarbonyl-co-imino-1,4-benzoyl)
Title Journal or Book Year
A carbon-13 CP/MAS nuclear magnetic resonance study of several 1,4-disubstituted benzenes in the solid state Canadian Journal of Chemistry 1989
Ab initio MO calculations and17O NMR at natural abundance ofpara-substituted acetophenones Organic Magnetic Resonance 1983
Nitrobenzene valence bond structures: evidence in support of through-resonance from oxygen-17 shieldings Journal of the American Chemical Society 1982
Oxygen-17 NMR studies of substituent and hydrogen-bonding effects in substituted acetophenones and benzaldehydes Journal of the American Chemical Society 1981
Nuclear magnetic resonance studies. XVI. Oxygen-17 shieldings of some substituted acetophenones Canadian Journal of Chemistry 1969

This compound is available in the following databases:

KnowItAll IR Spectral Library
Author: Wiley

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KnowItAll GC-MS Library
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KnowItAll NMR Spectral Library
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The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Wiley Registry of Mass Spectral Data 2026
Author: Wiley

The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.

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