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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[5-(4,5-dimethyl-2-nitrophenyl)-2-furanyl]methylene]-
SpectraBase Compound ID BouMpUfMnde
InChI InChI=1S/C17H13N3O6/c1-8-5-11(13(20(24)25)6-9(8)2)14-4-3-10(26-14)7-12-15(21)18-17(23)19-16(12)22/h3-7H,1-2H3,(H2,18,19,21,22,23)
InChIKey QYTPDYMLXCOCAT-UHFFFAOYSA-N
Mol Weight 355.31 g/mol
Molecular Formula C17H13N3O6
Exact Mass 355.080435 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JU3Jg0LKiRc
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[5-(4,5-dimethyl-2-nitrophenyl)-2-furanyl]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 355.080435145 u
Formula C17H13N3O6
InChI InChI=1S/C17H13N3O6/c1-8-5-11(13(20(24)25)6-9(8)2)14-4-3-10(26-14)7-12-15(21)18-17(23)19-16(12)22/h3-7H,1-2H3,(H2,18,19,21,22,23)
InChIKey QYTPDYMLXCOCAT-UHFFFAOYSA-N
Molecular Weight 355.306 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1937
Solvent DMSO-d6
Source Vendor ID: NMR/9243625; Lab Info: SAD; Lab Number: SAD-D000363