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3(2H)-benzofuranone, 6-hydroxy-7-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylene]-, (2E)-

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3(2H)-benzofuranone, 6-hydroxy-7-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylene]-, (2E)-
SpectraBase Compound ID K3v67i3utW
InChI InChI=1S/C26H29N3O5/c1-27-15-17(20-14-18(33-2)3-5-22(20)27)13-24-25(32)19-4-6-23(31)21(26(19)34-24)16-29-9-7-28(8-10-29)11-12-30/h3-6,13-15,30-31H,7-12,16H2,1-2H3/b24-13+
InChIKey JYEFICSZCAMMRS-ZMOGYAJESA-N
Mol Weight 463.53 g/mol
Molecular Formula C26H29N3O5
Exact Mass 463.210721 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID xYPCWBhfpB
Name 3(2H)-benzofuranone, 6-hydroxy-7-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylene]-, (2E)-
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/C26H29N3O5/c1-27-15-17(20-14-18(33-2)3-5-22(20)27)13-24-25(32)19-4-6-23(31)21(26(19)34-24)16-29-9-7-28(8-10-29)11-12-30/h3-6,13-15,30-31H,7-12,16H2,1-2H3/b24-13+
InChIKey JYEFICSZCAMMRS-ZMOGYAJESA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3951
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: F19378; Labnumber: ExLab-N0307-0052