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2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]-3-methylbutanoic acid
SpectraBase Compound ID 20iBwt98AjM
InChI InChI=1S/C8H11N3O4S/c1-3(2)4(7(13)14)16-6-5(12)9-8(15)11-10-6/h3-4H,1-2H3,(H,13,14)(H2,9,11,12,15)
InChIKey YHHGCZYATMZEHK-UHFFFAOYSA-N
Mol Weight 245.25 g/mol
Molecular Formula C8H11N3O4S
Exact Mass 245.047027 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E76YY6kgasv
Name 2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]-3-methylbutanoic acid
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/C8H11N3O4S/c1-3(2)4(7(13)14)16-6-5(12)9-8(15)11-10-6/h3-4H,1-2H3,(H,13,14)(H2,9,11,12,15)
InChIKey YHHGCZYATMZEHK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_1944
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: S17453UK10-812; Labnumber: S17453UK10-812; VK_ID: VK-001945
Temperature 315 °C