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acetic acid, [(5-hexyl-1,6-dihydro-4-hydroxy-6-oxo-2-pyrimidinyl)thio]-
SpectraBase Compound ID Cx9IzXFy62E
InChI InChI=1S/C12H18N2O4S/c1-2-3-4-5-6-8-10(17)13-12(14-11(8)18)19-7-9(15)16/h2-7H2,1H3,(H,15,16)(H2,13,14,17,18)
InChIKey SDDFHJUILKEVTJ-UHFFFAOYSA-N
Mol Weight 286.35 g/mol
Molecular Formula C12H18N2O4S
Exact Mass 286.098728 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HlvsGxJxXSu
Name acetic acid, [(5-hexyl-1,6-dihydro-4-hydroxy-6-oxo-2-pyrimidinyl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.098728238 u
Formula C12H18N2O4S
InChI InChI=1S/C12H18N2O4S/c1-2-3-4-5-6-8-10(17)13-12(14-11(8)18)19-7-9(15)16/h2-7H2,1H3,(H,15,16)(H2,13,14,17,18)
InChIKey SDDFHJUILKEVTJ-UHFFFAOYSA-N
Molecular Weight 286.346 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2256
Solvent DMSO-d6
Source Vendor ID: NMR/13268515