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alanine, N-[(2E)-2-[(4-bromobenzoyl)amino]-3-(2-furanyl)-1-oxo-2-propenyl]-
SpectraBase Compound ID 2qAARs8EvHe
InChI InChI=1S/C17H15BrN2O5/c1-10(17(23)24)19-16(22)14(9-13-3-2-8-25-13)20-15(21)11-4-6-12(18)7-5-11/h2-10H,1H3,(H,19,22)(H,20,21)(H,23,24)/b14-9+
InChIKey KOFDFWBHYYWRPW-NTEUORMPSA-N
Mol Weight 407.22 g/mol
Molecular Formula C17H15BrN2O5
Exact Mass 406.016435 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5xOjN4xrtgW
Name alanine, N-[(2E)-2-[(4-bromobenzoyl)amino]-3-(2-furanyl)-1-oxo-2-propenyl]-
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/C17H15BrN2O5/c1-10(17(23)24)19-16(22)14(9-13-3-2-8-25-13)20-15(21)11-4-6-12(18)7-5-11/h2-10H,1H3,(H,19,22)(H,20,21)(H,23,24)/b14-9+
InChIKey KOFDFWBHYYWRPW-NTEUORMPSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3421
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: NMR/11278350