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Isoamylnitrite

Compound with spectra: 8 NMR, 6 FTIR, 2 Raman, and 10 MS (GC)

Isoamylnitrite
SpectraBase Compound ID 7F8fY9Z1x8k
InChI InChI=1S/C5H11NO2/c1-5(2)3-4-8-6-7/h5H,3-4H2,1-2H3
InChIKey OWFXIOWLTKNBAP-UHFFFAOYSA-N
Mol Weight 117.15 g/mol
Molecular Formula C5H11NO2
Exact Mass 117.078979 g/mol

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ATR-IR Spectrum
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Inc.
Source of Spectrum Forensic Spectral Research
Catalog Number 15049-5

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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 Sigma-Aldrich
Catalog Number 150495

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MS (GC) Spectrum
Copyright Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS

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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-0-443-3

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum NP-0-4670-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum HE-1986-1900-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum SWG-33-1781-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum NP-16-6775-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum W5-1989-46382-19154

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13C NMR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20

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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.

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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 150495
Solvent CDCl3

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1H NMR Spectrum
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent CDCl3

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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 150495
Solvent CDCl3

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17O NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

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17O NMR Spectrum
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Solvent CDCl3

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Raman Spectrum
Copyright Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company LLC
Source of Spectrum Forensic Spectral Research
Catalog Number 150495

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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 150495

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Technique CAPILLARY CELL: 0.015 MM

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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 Sigma-Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 150495
Technique Neat

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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 150495
  • Isopentyl nitrite
  • Isopentyl nitrite (mixture of isomers)
  • ISOAMYL NITRITE Nitrous acid, 3-methylbutyl ester
  • isopentyl nitrile
  • OWFXIOWLTKNBAP-UHFFFAOYSA-N
  • ISOPENTYL-NITRITE;NITROUS-ACID,3-METHYLBUTYLESTER
  • Nitrous acid, isopentyl ester
  • ISOAMYL NITRITE /THE ANTISPASMODIC/
  • Nitrous acid, 3-methylbutyl ester
  • Amylnitrite
  • 3-Methylbutylnitrite
  • Aspiral
  • Nitramyl
  • Vaporole
  • Amilnitrit
  • Amilnitrite
  • Amyl nitrit
  • Pentanoli nitris
  • 3-Methylbutanol nitrite
  • Isopentyl alcohol, nitrite
  • Nitrous acid isoamyl ester
  • CCRIS 1098
  • HSDB 606
  • NCI-C50179
  • EINECS 203-770-8
  • NSC 7903
  • BRN 0969510
  • AI3-25183
  • Isoamylnitriet
  • IPN
o-Isopentylhydroxylamine
Isopentyl nitrate
n-Propyl nitrite
Isobutylnitrite
Oligo(2-methyloxacyclobutane)
Ethyl nitrite
1-Ethoxy-3-methyl-butane
Isoamyl formate
Butane, 1-(ethenyloxy)-3-methyl-
sec-Butyl nitrite
Title Journal or Book Year
Oxygen-17 Nuclear Magnetic Resonance. III. Oxygen Atoms with a Coordination Number of Two Bulletin of the Chemical Society of Japan 1979

This compound is available in the following databases:

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.

Wiley Registry of Mass Spectral Data 2023
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.

Pentyl nitrite
Ammonia
Vendor/Supplier Catalog Number
Sigma-Aldrich Company LLC
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