Methyl-1-(cyclohexylmethyl)-1H-indole-3-carboxylate

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Systematic / IUPAC Name: Methyl 1-(cyclohexylmethyl)-1H-indole-3-carboxylate

ID: Reference5445

Other Names: 1H-Indole-3-carboxylic acid, 1-(cyclohexylmethyl)-, methyl ester;
Methyl ester 1-(cyclohexylmethyl)-1H-indole-3-carboxylic acid

Formula: C17H21NO2

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

Methyl-1-(cyclohexylmethyl)-1H-indole-3-carboxylate 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 Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/5/2016 12:08:07 PM
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Identificators

InChI InChI=1S/C17H21NO2/c1-20-17(19)15-12-18(11-13-7-3-2-4-8-13)16-10-6-5-9-14(15)16/h5-6,9-10,12-13H,2-4,7-8,11H2,1H3
InChI Key KNWOMWABRWXHET-UHFFFAOYSA-N
Canonical SMILES O=C(OC)C1=CN(CC2CCCCC2)C3=C1C=CC=C3
CAS 858515829
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Other Names 1H-Indole-3-carboxylic acid, 1-(cyclohexylmethyl)-, methyl ester;
Methyl ester 1-(cyclohexylmethyl)-1H-indole-3-carboxylic acid

In Other Databases

ChemSpider 29342118