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Indole-3-butyric acid

Compound with spectra: 6 NMR, 8 FTIR, 3 Raman, and 7 MS (GC)

Indole-3-butyric acid
SpectraBase Compound ID 1SEcCtlnGSq
InChI InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)
InChIKey JTEDVYBZBROSJT-UHFFFAOYSA-N
Mol Weight 203.24 g/mol
Molecular Formula C12H13NO2
Exact Mass 203.094629 g/mol

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Amchem Products, Inc., Ambler, Pennsylvania
Technique KBr WAFER

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FTIR Spectrum
Copyright Copyright © 2012-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Cayman Chemical Company
Source of Spectrum Forensic Spectral Research
Catalog Number 22591
Technique KBr0

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample MCB MANUFACTURING CHEMISTS, NORWOOD, OHIO
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 A15260
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 139157
Technique Mull

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ATR-IR Spectrum
Copyright Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Cayman Chemical Company
Source of Spectrum Forensic Spectral Research
Catalog Number 22591

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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 A15260

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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 139157

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13C NMR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20

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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 139157
Solvent CDCl3 & DMSO-d6

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1H NMR Spectrum
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

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

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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 139157
Solvent CDCl3 & 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 A15260

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Raman Spectrum
Copyright Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Cayman Chemical Company
Source of Spectrum Forensic Spectral Research
Catalog Number 22591

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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 139157

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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 Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Source of Sample Sigma-Aldrich Cat. #45532
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)

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MS (GC) Spectrum
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Source of Spectrum Dr. Rolf Kuehnle
Technique GC/MS

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MS (GC) Spectrum
Copyright Copyright © 2016-2025  John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Cat. #45532
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum SRH-2022-4070-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AD-0-5056-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum CD-6-0-0
  • NSC 3130
  • β-Indolebutyric acid
  • 3-Indolebutyric acid
  • Hormodin
  • BUTYRIC ACID, 4-/3-INDOLYL/-,
  • 4-(1H-indol-3-yl)butanoic acid
  • 4-(3-Indolyl)-butyric acid
  • .beta.-IBA
  • Clonex
  • 1H-Indole-3-butanoic acid
  • Indolebutyric acid
  • Rhizopon AA
  • Seradix B 2
  • Seradix B 3
  • Hormex
  • Seradix
  • 1H-Indole-3-Butyric acid
  • Oxyberon
  • Chryzopon
  • Chryzosan
  • Chryzotek
  • Seradix 2
  • Seradix 3
  • Jiffy grow
  • Indolbutyric acid
  • Hormex rooting powder
  • Indole-3-butanoic acid
  • 3-Indolylbutyric acid
  • Indol-3-ylbutyric acid
  • Indolyl-3-butyric acid
  • 4-(Indol-3)-butyric acid
  • 4-(3-Indole)butyric acid
  • Butyric acid, 4-(indolyl)-
  • 4-(Indol-3-yl)butyric acid
  • Indol-3,4'-yl butyric acid
  • .gamma.-Indolebutyric acid
  • 4-(3-Indolyl)butanoic acid
  • 4-(1H-indol-3-yl)butyric acid
  • Gamma-(indol-3-yl)butyric acid
  • .gamma.-(Indole-3)-butyric acid
  • .gamma.-(3-Indolyl)butyric acid
  • 3-Indolyl-.gamma.-butyric acid
  • Kyselina 4-indol-3-ylmaselina
  • [3-(3-indolyl)propyl]carboxylic acid
  • STIM-ROOT
  • EPA PESTICIDE CHEMICAL CODE 046701
  • CASWELL NO. 499
  • CCRIS 1020
  • HSDB 7214
  • EINECS 205-101-5
  • BRN 0171120
  • AI3-17434
Indole-3-butyramide
6-(1H-indol-3-yl)hexanoic acid
5-(1H-indol-3-yl)pentanoic acid
3-Hexylindole
3-(16-hydroxyhexadecyl)indole
3-myristyl-1H-indole
(3-Indol-3-ylpropyl)hydrazine, maleate (1:1)
N-Butyltryptamine
Acetamide, N-[2-(1H-indol-3-yl)ethyl]-
Butyric acid, 4-[(2-indol-3-ylethyl)selenyl]-

This compound is available in the following databases:

KnowItAll NMR Spectral Library
Author: Wiley

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KnowItAll IR, Raman, and UV-Vis Spectral Libraries
Author: Wiley

The KnowItAll IR, Raman, and UV-Vis spectral libraries offer access to the world's largest collection of IR, Raman, and UV-Vis spectra, including the renowned Sadtler spectra. The libraries include a wide range of compounds from pure organics to industrial compounds. Learn more.

KnowItAll Mass Spectral Library
Author: Wiley

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Clonazepam
Vendor/Supplier Catalog Number
Cayman Chemical Company
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