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2-[(4-amino-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]-N-(5-methyl-3-isoxazolyl)butanamide
SpectraBase Compound ID DWSFcmKSWti
InChI InChI=1S/C12H15N5O3S/c1-3-7(11(19)15-9-4-6(2)20-17-9)21-12-14-8(13)5-10(18)16-12/h4-5,7H,3H2,1-2H3,(H,15,17,19)(H3,13,14,16,18)
InChIKey WAYYZLUTVXZHIO-UHFFFAOYSA-N
Mol Weight 309.34 g/mol
Molecular Formula C12H15N5O3S
Exact Mass 309.089561 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ASIGNTYRtKT
Name 2-[(4-amino-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]-N-(5-methyl-3-isoxazolyl)butanamide
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/C12H15N5O3S/c1-3-7(11(19)15-9-4-6(2)20-17-9)21-12-14-8(13)5-10(18)16-12/h4-5,7H,3H2,1-2H3,(H,15,17,19)(H3,13,14,16,18)
InChIKey WAYYZLUTVXZHIO-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1775
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: 9311343; UBI_ID: UBI-001776
Temperature 313 °C