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ethyl (2,5-dioxohexahydroimidazo[4,5-d]imidazol-1(2H)-yl)acetate
SpectraBase Compound ID Iotc8EgiDTk
InChI InChI=1S/C8H12N4O4/c1-2-16-4(13)3-12-6-5(10-8(12)15)9-7(14)11-6/h5-6H,2-3H2,1H3,(H,10,15)(H2,9,11,14)
InChIKey PFMXTUFEXPOPKQ-UHFFFAOYSA-N
Mol Weight 228.21 g/mol
Molecular Formula C8H12N4O4
Exact Mass 228.085855 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AHY7Jq1evpW
Name ethyl (2,5-dioxohexahydroimidazo[4,5-d]imidazol-1(2H)-yl)acetate
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/C8H12N4O4/c1-2-16-4(13)3-12-6-5(10-8(12)15)9-7(14)11-6/h5-6H,2-3H2,1H3,(H,10,15)(H2,9,11,14)
InChIKey PFMXTUFEXPOPKQ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2949
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: D06243; Labnumber: KRAV-0665; SBI_ID: SBI-002951
Temperature 315 °C