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5-[(Sec-butylamino)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID AHEIG0YrbU9
InChI InChI=1S/C9H13N3O3/c1-3-5(2)10-4-6-7(13)11-9(15)12-8(6)14/h4-5,10H,3H2,1-2H3,(H2,11,12,13,14,15)
InChIKey IALPNQFDEZWYCI-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 2FEfnoJOe2J
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[(1-methylpropyl)amino]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/c1-3-5(2)10-4-6-7(13)11-9(15)12-8(6)14/h4-5,10H,3H2,1-2H3,(H2,11,12,13,14,15)
InChIKey IALPNQFDEZWYCI-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_9852
Solvent DMSO-d6
Source Vendor ID: NMR/9301061; Lab Info: LP; Lab Number: LP-1701039