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2,4,5,6(1H,3H)-pyrimidinetetrone 5-[(7-ethyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazone]
SpectraBase Compound ID 2PVlIDu2yIJ
InChI InChI=1S/C12H12N8O5/c1-3-20-5-6(19(2)12(25)16-9(5)23)13-10(20)18-17-4-7(21)14-11(24)15-8(4)22/h3H2,1-2H3,(H,13,18)(H,16,23,25)(H2,14,15,21,22,24)
InChIKey XYQRZFVUKVQRCH-UHFFFAOYSA-N
Mol Weight 348.28 g/mol
Molecular Formula C12H12N8O5
Exact Mass 348.093066 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BKJUP9vrmJm
Name 2,4,5,6(1H,3H)-pyrimidinetetrone 5-[(7-ethyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazone]
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/C12H12N8O5/c1-3-20-5-6(19(2)12(25)16-9(5)23)13-10(20)18-17-4-7(21)14-11(24)15-8(4)22/h3H2,1-2H3,(H,13,18)(H,16,23,25)(H2,14,15,21,22,24)
InChIKey XYQRZFVUKVQRCH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25247
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: D49590; Labnumber: UZROM-3969; SBI_ID: SBI-025251
Temperature 318 °C