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4'-Cyanoacetanilide

Compound with spectra: 8 NMR, 5 FTIR, 2 Raman, and 4 MS (GC)

4'-Cyanoacetanilide
SpectraBase Compound ID CBRCJTuzu7a
InChI InChI=1S/C9H8N2O/c1-7(12)11-9-4-2-8(6-10)3-5-9/h2-5H,1H3,(H,11,12)
InChIKey UFKRTEWFEYWIHD-UHFFFAOYSA-N
Mol Weight 160.18 g/mol
Molecular Formula C9H8N2O
Exact Mass 160.063663 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 © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number A14941
Technique KBr1

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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 165050
Technique Mull

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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 © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Solvent Mixture

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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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13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3:CD3OD

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

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13C NMR 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 165050
Solvent CDCl3 & DMSO-d6

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15N 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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Raman Spectrum
Copyright Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number A14941

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Raman Spectrum
Copyright Copyright © 2017-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2025 John Wiley & Sons, Inc. All Rights Reserved.
Catalog Number 165050

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ATR-IR Spectrum
Copyright Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number A14941

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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 165050

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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 W5-1989-12299-1

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum C-97-3115-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum A1-11-2461/SM3-2l

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1H NMR 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 165050
Solvent CDCl3 & DMSO-d6
  • 4-Acetamido-benzonitrile
  • N-(4-cyanophenyl)acetamide
  • 4-Cyanoacetanilide
  • PARA-CYANOACETANILIDE
  • UFKRTEWFEYWIHD-UHFFFAOYSA-N
  • Acetamide, N-(4-cyanophenyl)-
  • 4-Cyano-N-acetaniline
  • N-Acetyl-4-cyanoaniline
  • 4-Cyano-N-acetylaniline
  • p-Cyanoacetanilide
  • Acetanilide, 4'-cyano-
  • p-Acetamidobenzonitirle
  • p-Acetaminobenzonitrile
  • p-Acetylamino-benzonitrile
  • N-(4-cyanophenyl)ethanamide
  • EINECS 252-685-2
  • NSC 88010
  • BRN 0776361
4-CYANOPHENYLUREA
N-[4-(aminomethyl)phenyl]acetamide
(4-Acetamidophenyl)methanammonium chloride
(4-Acetamidophenyl)methanamine hydrochloride
Dimethocaine-M (N,N-bisdeethyl-N-acetyl-) MS3_2
4'-Formylacetanilide
p-Ethylacetanilide
N-(4-ETHENYLPHENYL)-ACETAMIDE
N-[4-(Hydroxymethyl)phenyl]acetamide
N-(4-Bromomethylphenyl)acetamide
Title Journal or Book Year
DNA Binding Compounds. V. Synthesis and Characterization of Boron Containing Bibenzimidazoles Related to the DNA Minor Groove Binder, Hoechst-33258 Australian Journal of Chemistry 1994
Nitrogen-15 NMR studies of 5-substituted indoles and 4-substituted acetanilides. Evidence for cross-conjugation effects Magnetic Resonance in Chemistry 1993
Substituent effects on the N.M.R. spectra of carboxylic acid derivatives. III. Correlation of 13C N.M.R. spectra of para substituted acetanilides and 4'-nitrophenyl 4-substituted benzoates with infrared carbonyl stretching frequencies, 1H N.M.R., rate and equilibrium data Australian Journal of Chemistry 1984

This compound is available in the following databases:

KnowItAll IR Spectral Library
Author: Wiley

Wiley's KnowItAll IR Spectral Library offers access to the world's largest collection of high-quality infrared spectra, including the renowned Sadtler databases. Learn more.

KnowItAll Raman Spectral Library
Author: Wiley

Wiley's KnowItAll Raman Spectral Library offers access to the world's largest collection of high-quality Raman spectra, including the renowned Sadtler databases. Learn more.

Sigma-Aldrich Library of Raman Spectra
Author: Wiley/Sigma-Aldrich

Wiley, on behalf of Merck KGaA Darmstadt, Germany, releases the Sigma-Aldrich Library of Raman Spectra, featuring over 6,480 high-quality Raman spectra. Learn more.

Sigma-Aldrich Library of ATR-IR Spectra
Author: Sigma Aldrich

The Sigma-Aldrich Library of ATR-IR Spectra is a comprehensive collection of ATR-IR spectra sourced from the laboratories of Sigma-Aldrich by Merck KGaA Darmstadt, Germany. Learn more.

Sigma-Aldrich Library of FT-IR Spectra
Author: Sigma Aldrich

The Sigma-Aldrich Library of FT-IR Spectra is a comprehensive collection of FT-IR spectra sourced from the laboratories of Sigma-Aldrich by Merck KGaA Darmstadt, Germany. Learn more.

Sigma Aldrich NMR Library
Author: Sigma Aldrich

The Sigma-Aldrich Library of NMR Spectra is a comprehensive collection of NMR spectra for organic compounds sourced from the laboratories of Sigma-Aldrich by Merck KGaA Darmstadt, Germany. Learn more.

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