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3-(Trifluoromethyl)benzaldehyde

Compound with spectra: 9 NMR, 3 FTIR, 1 Raman, and 2 MS (GC)

3-(Trifluoromethyl)benzaldehyde
SpectraBase Compound ID 4zVld1HDMgP
InChI InChI=1S/C8H5F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-5H
InChIKey NMTUHPSKJJYGML-UHFFFAOYSA-N
Mol Weight 174.12 g/mol
Molecular Formula C8H5F3O
Exact Mass 174.029249 g/mol

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CDCl3

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13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CDCl3

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CDCl3

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

13C NMR Spectrum
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CDCl3

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

13C NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 196878
Solvent CDCl3

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19F NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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17O NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent FSO3H:SBF5(1:1)/SO2

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

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum W6-11906-0-0

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

ATR-IR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 196878

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

1H NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 196878
Solvent CDCl3

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FTIR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 196878
Technique Neat

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Raman Spectrum
Copyright Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved.
Catalog Number 196878

View Spectrum of 3-(Trifluoromethyl)benzaldehyde

Vapor Phase IR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 196878
  • NMTUHPSKJJYGML-UHFFFAOYSA-N
  • 3-TRIFLUOROMETHYL-BENZOYL-CATION
  • Benzaldehyde, 3-(trifluoromethyl)-
  • alpha,alpha,alpha-Trifluoro-m-tolualdehyde
3-Trifluoromethyl-benzylalcohol
3-Isopropyl-benzaldehyde
3-Acylium-protonated benzoic acid, dication
4-(Trifluoromethyl)benzoyl chloride
4-TRIFLUOROMETHYL-BENZOIC-ACID-FLUORIDE
1-(tert-Butyl)-3-vinylbenzene
3-Dimethylamino-benzaldehyde
QZMGMXBYJZVAJN-UHFFFAOYSA-N
3-(Difluoromethyl)benzonitrile
4-Trifluoromethylbenzamide
Title Journal or Book Year
Oxygen-17 NMR spectroscopic study of substituted benzoyl cations The Journal of Organic Chemistry 1984

This compound is available in the following databases:

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.

Mass Spectra of Designer Drugs 2024
Author: Peter Rösner

This library enables fast and reliable identification of the latest illegal designer drugs. It is updated annually. Learn more.

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