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methyl 2-(6-methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)propanoate
SpectraBase Compound ID 85WkLNBkNNW
InChI InChI=1S/C9H12N2O3S/c1-4(8(13)14-3)6-5(2)10-9(15)11-7(6)12/h4H,1-3H3,(H2,10,11,12,15)
InChIKey DESHPZJOAKWKOB-UHFFFAOYSA-N
Mol Weight 228.27 g/mol
Molecular Formula C9H12N2O3S
Exact Mass 228.056863 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AeJDIpmG48H
Name methyl 2-(6-methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)propanoate
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/C9H12N2O3S/c1-4(8(13)14-3)6-5(2)10-9(15)11-7(6)12/h4H,1-3H3,(H2,10,11,12,15)
InChIKey DESHPZJOAKWKOB-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20079
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: D18324; Labnumber: AMIR1-6994; SBI_ID: SBI-020083
Temperature 306 °C