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Ethyl 5-hydroxy-1-isobutyl-2-methyl-1H-indole-3-carboxylate
SpectraBase Compound ID AUrX661cXvb
InChI InChI=1S/C16H21NO3/c1-5-20-16(19)15-11(4)17(9-10(2)3)14-7-6-12(18)8-13(14)15/h6-8,10,18H,5,9H2,1-4H3
InChIKey WIVRHTPQXBZLGI-UHFFFAOYSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBknlHOEA8
Name Ethyl 5-hydroxy-1-isobutyl-2-methyl-1H-indole-3-carboxylate
Alternate Name(s) 5-Hydroxy-1-isobutyl-2-methyl-indole-3-carboxylic acid ethyl ester 5-Hydroxy-2-methyl-1-(2-methylpropyl)-3-indolecarboxylic acid ethyl ester Ethyl 2-methyl-1-(2-methylpropyl)-5-oxidanyl-indole-3-carboxylate Ethyl 5-hydroxy-1-isobutyl-2-methyl-indole-3-carboxylate Ethyl 5-hydroxy-2-methyl-1-(2-methylpropyl)indole-3-carboxylate Indole-3-carboxylic acid, 5-hydroxy-2-methyl-1-(2-methylpropyl)-, ethyl ester
CAS Registry Number 61793-35-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-5-20-16(19)15-11(4)17(9-10(2)3)14-7-6-12(18)8-13(14)15/h6-8,10,18H,5,9H2,1-4H3
InChIKey WIVRHTPQXBZLGI-UHFFFAOYSA-N
Molecular Weight 275.348 g/mol
SMILES Oc1cc2c(c([n](CC(C)C)c2cc1)C)C(=O)OCC
SPLASH splash10-003r-3490000000-2d460bb54570c991b413
Source of Spectrum AD-0-2532-0
Wiley ID 1431360