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homocysteine, N-[(2Z)-3-(2-furanyl)-2-[(3-nitrobenzoyl)amino]-1-oxo-2-propenyl]-S-methyl-
SpectraBase Compound ID Iv7EjET3aXh
InChI InChI=1S/C19H19N3O7S/c1-30-9-7-15(19(25)26)20-18(24)16(11-14-6-3-8-29-14)21-17(23)12-4-2-5-13(10-12)22(27)28/h2-6,8,10-11,15H,7,9H2,1H3,(H,20,24)(H,21,23)(H,25,26)/b16-11-
InChIKey AFDBDPJNLNSGGO-WJDWOHSUSA-N
Mol Weight 433.44 g/mol
Molecular Formula C19H19N3O7S
Exact Mass 433.094371 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bgk21wlgr77
Name homocysteine, N-[(2Z)-3-(2-furanyl)-2-[(3-nitrobenzoyl)amino]-1-oxo-2-propenyl]-S-methyl-
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/C19H19N3O7S/c1-30-9-7-15(19(25)26)20-18(24)16(11-14-6-3-8-29-14)21-17(23)12-4-2-5-13(10-12)22(27)28/h2-6,8,10-11,15H,7,9H2,1H3,(H,20,24)(H,21,23)(H,25,26)/b16-11-
InChIKey AFDBDPJNLNSGGO-WJDWOHSUSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3428
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/11278360