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6-Bromo-1-cyclohexyl-5-hydroxy-2-(1-pyrrolidinylmethyl)-3-indolecarboxylic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

6-Bromo-1-cyclohexyl-5-hydroxy-2-(1-pyrrolidinylmethyl)-3-indolecarboxylic acid ethyl ester
SpectraBase Compound ID IQbRG6ewh3l
InChI InChI=1S/C22H29BrN2O3/c1-2-28-22(27)21-16-12-20(26)17(23)13-18(16)25(15-8-4-3-5-9-15)19(21)14-24-10-6-7-11-24/h12-13,15,26H,2-11,14H2,1H3
InChIKey HKHYEHXGYQSAQD-UHFFFAOYSA-N
Mol Weight 449.39 g/mol
Molecular Formula C22H29BrN2O3
Exact Mass 448.136156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5v0RVEU2hO5
Name 6-Bromo-1-cyclohexyl-5-hydroxy-2-(1-pyrrolidinylmethyl)-3-indolecarboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29BrN2O3
InChI InChI=1S/C22H29BrN2O3/c1-2-28-22(27)21-16-12-20(26)17(23)13-18(16)25(15-8-4-3-5-9-15)19(21)14-24-10-6-7-11-24/h12-13,15,26H,2-11,14H2,1H3
InChIKey HKHYEHXGYQSAQD-UHFFFAOYSA-N
Molecular Weight 449.389 g/mol
SMILES Oc1c(Br)cc2c(c(c([n]2C2CCCCC2)CN2CCCC2)C(=O)OCC)c1
SPLASH splash10-0gi1-2139600000-0dc309ccb724e3074323
Synonyms 6-Bromo-1-cyclohexyl-5-hydroxy-2-(pyrrolidinomethyl)indole-3-carboxylic acid ethyl ester Ethyl 6-bromanyl-1-cyclohexyl-5-oxidanyl-2-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Ethyl 6-bromo-1-cyclohexyl-5-hydroxy-2-(pyrrolidin-1-ylmethyl)indole-3-carboxylate
Wiley ID 1436608