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2-Butyl-1-(methoxyphenylmethyl)-5-phenylindole-3-carboxylic acid methyl ester
SpectraBase Compound ID 11o3zHJSYVI
InChI InChI=1S/C28H29NO3/c1-4-5-16-25-26(28(30)32-3)23-19-22(20-12-8-6-9-13-20)17-18-24(23)29(25)27(31-2)21-14-10-7-11-15-21/h6-15,17-19,27H,4-5,16H2,1-3H3
InChIKey VWJBTUZSVLDOAN-UHFFFAOYSA-N
Mol Weight 427.54 g/mol
Molecular Formula C28H29NO3
Exact Mass 427.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxyBzzM3LJH
Name 2-Butyl-1-(methoxyphenylmethyl)-5-phenylindole-3-carboxylic acid methyl ester
Alternate Name(s) Methyl 2-butyl-1-(methoxy(phenyl)methyl)-5-phenyl-1H-indole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H29NO3
InChI InChI=1S/C28H29NO3/c1-4-5-16-25-26(28(30)32-3)23-19-22(20-12-8-6-9-13-20)17-18-24(23)29(25)27(31-2)21-14-10-7-11-15-21/h6-15,17-19,27H,4-5,16H2,1-3H3
InChIKey VWJBTUZSVLDOAN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000642
Molecular Weight 427.544 g/mol
SMILES c1([n](c2ccc(cc2c1C(=O)OC)-c1ccccc1)C(c1ccccc1)OC)CCCC
SPLASH splash10-00di-2900100000-accd95d0520da4eeb9d0
Source of Spectrum ASC-352-3360-4ga
Wiley ID 1764177