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ethyl 1-benzyl-6-bromo-5-hydroxy-2-{[4-(2-methylphenyl)-1-piperazinyl]methyl}-1H-indole-3-carboxylate
SpectraBase Compound ID DpC1uWonFPb
InChI InChI=1S/C30H32BrN3O3/c1-3-37-30(36)29-23-17-28(35)24(31)18-26(23)34(19-22-10-5-4-6-11-22)27(29)20-32-13-15-33(16-14-32)25-12-8-7-9-21(25)2/h4-12,17-18,35H,3,13-16,19-20H2,1-2H3
InChIKey QDMZABCJBHJAKY-UHFFFAOYSA-N
Mol Weight 562.5 g/mol
Molecular Formula C30H32BrN3O3
Exact Mass 561.162705 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KG97EfvBPHx
Name ethyl 1-benzyl-6-bromo-5-hydroxy-2-{[4-(2-methylphenyl)-1-piperazinyl]methyl}-1H-indole-3-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C30H32BrN3O3/c1-3-37-30(36)29-23-17-28(35)24(31)18-26(23)34(19-22-10-5-4-6-11-22)27(29)20-32-13-15-33(16-14-32)25-12-8-7-9-21(25)2/h4-12,17-18,35H,3,13-16,19-20H2,1-2H3
InChIKey QDMZABCJBHJAKY-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_4544
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/8046739; Labnumber: JMR-0001509; IOH_ID: IOH-004545
Temperature 303 °C