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5-[(Butylamino)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID BmXJHym8b6a
InChI InChI=1S/C9H13N3O3/c1-2-3-4-10-5-6-7(13)11-9(15)12-8(6)14/h5,10H,2-4H2,1H3,(H2,11,12,13,14,15)
InChIKey RYNPELLBQFOMHN-UHFFFAOYSA-N
Mol Weight 211.22 g/mol
Molecular Formula C9H13N3O3
Exact Mass 211.095691 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1GtXROF6B29
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[(butylamino)methylene]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 211.095691288 u
Formula C9H13N3O3
InChI InChI=1S/C9H13N3O3/c1-2-3-4-10-5-6-7(13)11-9(15)12-8(6)14/h5,10H,2-4H2,1H3,(H2,11,12,13,14,15)
InChIKey RYNPELLBQFOMHN-UHFFFAOYSA-N
Molecular Weight 211.221 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9056
Solvent DMSO-d6
Source Vendor ID: NMR/9301056; Lab Info: LP; Lab Number: LP-1701034