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2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl 2-(benzoylamino)-4-(methylsulfanyl)butanoate
SpectraBase Compound ID IV8IgMXaEv5
InChI InChI=1S/C18H21N3O5S/c1-12-10-15(21-26-12)20-16(22)11-25-18(24)14(8-9-27-2)19-17(23)13-6-4-3-5-7-13/h3-7,10,14H,8-9,11H2,1-2H3,(H,19,23)(H,20,21,22)
InChIKey TXLSLKWXAFYZMC-UHFFFAOYSA-N
Mol Weight 391.44 g/mol
Molecular Formula C18H21N3O5S
Exact Mass 391.120192 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6MZ5Y93AeNo
Name 2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl 2-(benzoylamino)-4-(methylsulfanyl)butanoate
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/C18H21N3O5S/c1-12-10-15(21-26-12)20-16(22)11-25-18(24)14(8-9-27-2)19-17(23)13-6-4-3-5-7-13/h3-7,10,14H,8-9,11H2,1-2H3,(H,19,23)(H,20,21,22)
InChIKey TXLSLKWXAFYZMC-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_807
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/8169277; Labnumber: L-23/0006574