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Ethyl 2-[(4-amino-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate
SpectraBase Compound ID 14UVAeMweRS
InChI InChI=1S/C8H11N3O3S/c1-2-14-7(13)4-15-8-10-5(9)3-6(12)11-8/h3H,2,4H2,1H3,(H3,9,10,11,12)
InChIKey WCURZVWSLCULFV-UHFFFAOYSA-N
Mol Weight 229.25 g/mol
Molecular Formula C8H11N3O3S
Exact Mass 229.052112 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CjBWw5pmz36
Name acetic acid, [(4-amino-6-hydroxy-2-pyrimidinyl)thio]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 229.052112397 u
Formula C8H11N3O3S
InChI InChI=1S/C8H11N3O3S/c1-2-14-7(13)4-15-8-10-5(9)3-6(12)11-8/h3H,2,4H2,1H3,(H3,9,10,11,12)
InChIKey WCURZVWSLCULFV-UHFFFAOYSA-N
Molecular Weight 229.254 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16951
Solvent DMSO-d6
Source Vendor ID: ZI/10062645; Lab Info: MIH; Lab Number: MIH-0001014