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N,N-dimethylmethanaminium 5-acetyl-3-(4-ethylphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinolate

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N,N-dimethylmethanaminium 5-acetyl-3-(4-ethylphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinolate
SpectraBase Compound ID 5nzPngZODSn
InChI InChI=1S/C14H14N2O4.C3H9N/c1-3-9-4-6-10(7-5-9)16-13(19)11(8(2)17)12(18)15-14(16)20;1-4(2)3/h4-7,19H,3H2,1-2H3,(H,15,18,20);1-3H3
InChIKey XAAUCNLCSIQUHZ-UHFFFAOYSA-N
Mol Weight 333.39 g/mol
Molecular Formula C17H23N3O4
Exact Mass 333.168856 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KjR9biH707U
Name N,N-dimethylmethanaminium 5-acetyl-3-(4-ethylphenyl)-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinolate
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/C14H14N2O4.C3H9N/c1-3-9-4-6-10(7-5-9)16-13(19)11(8(2)17)12(18)15-14(16)20;1-4(2)3/h4-7,19H,3H2,1-2H3,(H,15,18,20);1-3H3
InChIKey XAAUCNLCSIQUHZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7384
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: D29696; Labnumber: KVEX-30045; SBI_ID: SBI-007387
Temperature 318 °C