Indole-3-butyric acid

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Systematic / IUPAC Name: 4-(1H-Indol-3-yl)butanoic acid

ID: Reference447

Other Names: [3-(3-Indolyl)propyl]carboxylic acid;
3-Indolebutyric acid;
Indolebutyric acid;
Hormodin;
1H-Indole-3-butanoic acid ; more

Formula: C12H13NO2

Class: Endogenous Metabolites

Spectral Data

Indole-3-butyric acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 268
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI
Analyzers FT
Last Modification 1/21/2015 9:00:10 AM
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Identificators

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)
InChI Key JTEDVYBZBROSJT-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O
CAS 133324
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Other Names [3-(3-Indolyl)propyl]carboxylic acid;
3-Indolebutyric acid;
Indolebutyric acid;
Hormodin;
1H-Indole-3-butanoic acid;
Indole-3-butanoic acid;
Seradix;
Hormex rooting powder;
1H-Indole-3-butyric acid;
4-(3-Indolyl)butyric acid;
4-(Indol-3-yl)butyric acid;
Indolbutyric acid;
Seradix 2;
Butyric acid, 4-(indolyl)-;
4-Indol-3-ylbutyric acid;
4-(3-Indolyl)butanoic acid;
Indole 3-butyric acid;
Indolyl-3-butyric acid;
4-(1H-Indol-3-yl)butyric acid;
Indole-3-butyrate;
4-Indol-3-ylbutanoic acid;
Oxyberon;
Hormex;
3-Iodolebutyrate;
Indolyl-3-butyrate;
Indole-3-butrylic acid;
4-(Indolyl)-butyric acid;
4-(3-Indole)-butyric acid;
Υ-(Indole-3)-butyric acid;
Υ-(3-Indolyl)butyric acid

In Other Databases

Wikipedia Indole-3-butyric_acid
KEGG C11284
HMDb HMDB02096
PubChem 8617
ChemIDPlus 000133324
ChEMBL CHEMBL582878
ChemSpider 8298
ChEBI CHEBI:33070