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alanine, N-[(2Z)-2-[(3-bromobenzoyl)amino]-3-(3-nitrophenyl)-1-oxo-2-propenyl]-
SpectraBase Compound ID 6ie8vXDbRdI
InChI InChI=1S/C19H16BrN3O6/c1-11(19(26)27)21-18(25)16(9-12-4-2-7-15(8-12)23(28)29)22-17(24)13-5-3-6-14(20)10-13/h2-11H,1H3,(H,21,25)(H,22,24)(H,26,27)/b16-9-
InChIKey PXMRQFCWUKGHFL-SXGWCWSVSA-N
Mol Weight 462.26 g/mol
Molecular Formula C19H16BrN3O6
Exact Mass 461.022248 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7EqeOcqnbgF
Name alanine, N-[(2Z)-2-[(3-bromobenzoyl)amino]-3-(3-nitrophenyl)-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/C19H16BrN3O6/c1-11(19(26)27)21-18(25)16(9-12-4-2-7-15(8-12)23(28)29)22-17(24)13-5-3-6-14(20)10-13/h2-11H,1H3,(H,21,25)(H,22,24)(H,26,27)/b16-9-
InChIKey PXMRQFCWUKGHFL-SXGWCWSVSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_3515
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/11249524