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Methyl 1-Butyl-2-phenyl-1H-indole-3-carboxylate

View entire compound with spectra: 3 MS (GC)

Methyl 1-Butyl-2-phenyl-1H-indole-3-carboxylate
SpectraBase Compound ID 4yYZMmB81X0
InChI InChI=1S/C20H21NO2/c1-3-4-14-21-17-13-9-8-12-16(17)18(20(22)23-2)19(21)15-10-6-5-7-11-15/h5-13H,3-4,14H2,1-2H3
InChIKey CEDDRKAGPFJUPJ-UHFFFAOYSA-N
Mol Weight 307.39 g/mol
Molecular Formula C20H21NO2
Exact Mass 307.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fKyHgH9mVv
Name Methyl 1-Butyl-2-phenyl-1H-indole-3-carboxylate
Comments Edited after expert review - Original record with SpectrumID 1715349 removed
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO2
InChI InChI=1S/C20H21NO2/c1-3-4-14-21-17-13-9-8-12-16(17)18(20(22)23-2)19(21)15-10-6-5-7-11-15/h5-13H,3-4,14H2,1-2H3
InChIKey CEDDRKAGPFJUPJ-UHFFFAOYSA-N
Molecular Weight 307.393 g/mol
SMILES c1([n](c2ccccc2c1C(=O)OC)CCCC)-c1ccccc1
SPLASH splash10-00dl-7490000000-1db4db1c2e90c1ba71a5
Source of Spectrum U1-2012-2556-2i
Synonyms 1-Butyl-2-phenyl-3-indolecarboxylic acid methyl ester Methyl 1-butyl-2-phenylindole-3-carboxylate Methyl 1-butyl-2-phenyl-indole-3-carboxylate
Wiley ID 1718229