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Ethyl 1-[(3-cyano-1-methyl-1H-indol-2-yl)methyl]-4-phenyl-4-piperidinecarboxylate
SpectraBase Compound ID 1T6yEmPjSDW
InChI InChI=1S/C25H27N3O2/c1-3-30-24(29)25(19-9-5-4-6-10-19)13-15-28(16-14-25)18-23-21(17-26)20-11-7-8-12-22(20)27(23)2/h4-12H,3,13-16,18H2,1-2H3
InChIKey IBLYZNAARQFSHC-UHFFFAOYSA-N
Mol Weight 401.51 g/mol
Molecular Formula C25H27N3O2
Exact Mass 401.210327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKqSNP1yZaF
Name Ethyl 1-[(3-cyano-1-methyl-1H-indol-2-yl)methyl]-4-phenyl-4-piperidinecarboxylate
CAS Registry Number 330556-61-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27N3O2
InChI InChI=1S/C25H27N3O2/c1-3-30-24(29)25(19-9-5-4-6-10-19)13-15-28(16-14-25)18-23-21(17-26)20-11-7-8-12-22(20)27(23)2/h4-12H,3,13-16,18H2,1-2H3
InChIKey IBLYZNAARQFSHC-UHFFFAOYSA-N
Molecular Weight 401.510 g/mol
SMILES c1(c(c2ccccc2[n]1C)C#N)CN1CCC(CC1)(C(=O)OCC)c1ccccc1
SPLASH splash10-0gb9-1920200000-a5c49193661d7f0626bc
Source of Spectrum AD-0-2532-0
Synonyms 1-[(3-cyano-1-methyl-2-indolyl)methyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester 1-[(3-cyano-1-methyl-indol-2-yl)methyl]-4-phenyl-isonipecotic acid ethyl ester Ethyl 1-[(3-cyano-1-methyl-indol-2-yl)methyl]-4-phenyl-piperidine-4-carboxylate Piperidine-4-carboxylic acid, 1-(3-cyano-1-methyl-2-indolylmethyl)-4-phenyl-, ethyl ester
Wiley ID 1432890