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methyl 4-methyl-3-[({4-[(2E)-3-phenyl-2-propenyl]-1-piperazinyl}acetyl)amino]-1H-indole-2-carboxylate
SpectraBase Compound ID GpB0yEdkEkd
InChI InChI=1S/C26H30N4O3/c1-19-8-6-12-21-23(19)24(25(27-21)26(32)33-2)28-22(31)18-30-16-14-29(15-17-30)13-7-11-20-9-4-3-5-10-20/h3-12,27H,13-18H2,1-2H3,(H,28,31)/b11-7+
InChIKey KMCRWHVLXSQWBM-YRNVUSSQSA-N
Mol Weight 446.55 g/mol
Molecular Formula C26H30N4O3
Exact Mass 446.231791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HENqtMnVgIG
Name methyl 4-methyl-3-[({4-[(2E)-3-phenyl-2-propenyl]-1-piperazinyl}acetyl)amino]-1H-indole-2-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/C26H30N4O3/c1-19-8-6-12-21-23(19)24(25(27-21)26(32)33-2)28-22(31)18-30-16-14-29(15-17-30)13-7-11-20-9-4-3-5-10-20/h3-12,27H,13-18H2,1-2H3,(H,28,31)/b11-7+
InChIKey KMCRWHVLXSQWBM-YRNVUSSQSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13706
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: D88754; Labnumber: SIMAK-01905; SBI_ID: SBI-013709
Synonyms methyl 4-methyl-3-[({4-[3-phenyl-2-propenyl]-1-piperazinyl}acetyl)amino]-1H-indole-2-carboxylate
Temperature 308 °C