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ethyl 6-bromo-2-{[4-(2-hydroxyethyl)-1-piperazinyl]methyl}-5-methoxy-1-methyl-1H-indole-3-carboxylate
SpectraBase Compound ID HwL9gMnVLZc
InChI InChI=1S/C20H28BrN3O4/c1-4-28-20(26)19-14-11-18(27-3)15(21)12-16(14)22(2)17(19)13-24-7-5-23(6-8-24)9-10-25/h11-12,25H,4-10,13H2,1-3H3
InChIKey QKHSIGOGHUFURF-UHFFFAOYSA-N
Mol Weight 454.37 g/mol
Molecular Formula C20H28BrN3O4
Exact Mass 453.126319 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7rHNWADSkJD
Name ethyl 6-bromo-2-{[4-(2-hydroxyethyl)-1-piperazinyl]methyl}-5-methoxy-1-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/C20H28BrN3O4/c1-4-28-20(26)19-14-11-18(27-3)15(21)12-16(14)22(2)17(19)13-24-7-5-23(6-8-24)9-10-25/h11-12,25H,4-10,13H2,1-3H3
InChIKey QKHSIGOGHUFURF-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3657
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: D37597; Labnumber: NIG-2271; SBI_ID: SBI-003659
Temperature 315 °C