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4-(methylsulfanyl)-2-[(3-pyridinylcarbonyl)amino]butanoate

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4-(methylsulfanyl)-2-[(3-pyridinylcarbonyl)amino]butanoate
SpectraBase Compound ID 1kjIPrbjgWs
InChI InChI=1S/C11H14N2O3S/c1-17-6-4-9(11(15)16)13-10(14)8-3-2-5-12-7-8/h2-3,5,7,9H,4,6H2,1H3,(H,13,14)(H,15,16)/p-1
InChIKey XPOZUYPEUMYKMV-UHFFFAOYSA-M
Mol Weight 253.3 g/mol
Molecular Formula C11H13N2O3S
Exact Mass 253.064688 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HP6c1KWU374
Name 4-(methylsulfanyl)-2-[(3-pyridinylcarbonyl)amino]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/C11H14N2O3S/c1-17-6-4-9(11(15)16)13-10(14)8-3-2-5-12-7-8/h2-3,5,7,9H,4,6H2,1H3,(H,13,14)(H,15,16)/p-1
InChIKey XPOZUYPEUMYKMV-UHFFFAOYSA-M
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_2688
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/6063952; Labnumber: NP-TR01107; IOH_ID: IOH-002689
Temperature 297 °C