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4-Chloro-3-nitro-benzonitrile

Compound with spectra: 5 NMR, 6 FTIR, 1 Raman, and 5 MS (GC)

4-Chloro-3-nitro-benzonitrile
SpectraBase Compound ID KWx61bhnWbH
InChI InChI=1S/C7H3ClN2O2/c8-6-2-1-5(4-9)3-7(6)10(11)12/h1-3H
InChIKey XBLPHYSLHRGMNW-UHFFFAOYSA-N
Mol Weight 182.57 g/mol
Molecular Formula C7H3ClN2O2
Exact Mass 181.988305 g/mol

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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 © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum QF-40-369-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AD-0-2532-0

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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 SK-28-4298-0

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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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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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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 380059
Solvent CDCl3

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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 A12648

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample J. Brieux, University of Buenos Aires, Buenos Aires, Argentina
Technique KBr WAFER

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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 A12648
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 380059
Technique Mull

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ATR-IR 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 A12648

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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 380059

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

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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 380059
Solvent CDCl3
  • 2-Nitro-4-cyanophenyl chloride
  • XBLPHYSLHRGMNW-UHFFFAOYSA-N
  • Benzonitrile, 4-chloro-3-nitro-
  • 4-Chlor-3-nitrobenzonitril
  • 4-Chloranyl-3-nitro-benzenecarbonitrile
  • EINECS 213-364-2
  • BRN 1639111
4-Hydroxy-3-nitro-benzonitrile
4-Chloro-3-nitroanisole
2-Chloro-5-nitro-benzonitrile
3-Amino-4-chloro-5-(hydroxyamino)benzonitrile
4-Methyl-3-nitrobenzaldehyde
2-(4-Chloro-3-nitrophenyl)acetonitrile
2-Chloro-5-nitro-benzylalcohol
4-Methyl-3-nitroanisole
alpha-Bromo-4-nitro-o-cresol
4-hydroxy-3-nitrophenyldiazonium tetrafluoroborate
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