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Ethyl 5-(acetyloxy)-1-benzyl-6-bromo-2-methyl-1H-indole-3-carboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Ethyl 5-(acetyloxy)-1-benzyl-6-bromo-2-methyl-1H-indole-3-carboxylate
SpectraBase Compound ID LyUDRGu6tlp
InChI InChI=1S/C21H20BrNO4/c1-4-26-21(25)20-13(2)23(12-15-8-6-5-7-9-15)18-11-17(22)19(10-16(18)20)27-14(3)24/h5-11H,4,12H2,1-3H3
InChIKey RKKXDBXPBMUKMA-UHFFFAOYSA-N
Mol Weight 430.3 g/mol
Molecular Formula C21H20BrNO4
Exact Mass 429.057571 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LLbw4DoBJHr
Name 1H-indole-3-carboxylic acid, 5-(acetyloxy)-6-bromo-2-methyl-1-(phenylmethyl)-, ethyl ester
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/C21H20BrNO4/c1-4-26-21(25)20-13(2)23(12-15-8-6-5-7-9-15)18-11-17(22)19(10-16(18)20)27-14(3)24/h5-11H,4,12H2,1-3H3
InChIKey RKKXDBXPBMUKMA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_3267
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/6055076; Labnumber: JMR-0277; IOH_ID: IOH-010270
Temperature 303 °C