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1,3-diethyl-5-[(5-nitro-2-furyl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID 50tjazjfAFg
InChI InChI=1S/C13H13N3O5S/c1-3-14-11(17)9(12(18)15(4-2)13(14)22)7-8-5-6-10(21-8)16(19)20/h5-7H,3-4H2,1-2H3
InChIKey XOGVYFGTWPFEQC-UHFFFAOYSA-N
Mol Weight 323.32 g/mol
Molecular Formula C13H13N3O5S
Exact Mass 323.057592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JqHm1pij73O
Name 1,3-diethyl-5-[(5-nitro-2-furyl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C13H13N3O5S/c1-3-14-11(17)9(12(18)15(4-2)13(14)22)7-8-5-6-10(21-8)16(19)20/h5-7H,3-4H2,1-2H3
InChIKey XOGVYFGTWPFEQC-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34863
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: 9685111; SBI_ID: SBI-034867
Temperature 308 °C