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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[4-(dimethylamino)-3-nitrophenyl]methylene]-1-(1,1-dimethylethyl)-, (5E)-
SpectraBase Compound ID 9Dtj4Uwa5O1
InChI InChI=1S/C17H20N4O5/c1-17(2,3)20-15(23)11(14(22)18-16(20)24)8-10-6-7-12(19(4)5)13(9-10)21(25)26/h6-9H,1-5H3,(H,18,22,24)/b11-8+
InChIKey MBSCYYFTGCJCPI-DHZHZOJOSA-N
Mol Weight 360.37 g/mol
Molecular Formula C17H20N4O5
Exact Mass 360.14337 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EeDW56yANDk
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[4-(dimethylamino)-3-nitrophenyl]methylene]-1-(1,1-dimethylethyl)-, (5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.143369755 u
Formula C17H20N4O5
InChI InChI=1S/C17H20N4O5/c1-17(2,3)20-15(23)11(14(22)18-16(20)24)8-10-6-7-12(19(4)5)13(9-10)21(25)26/h6-9H,1-5H3,(H,18,22,24)/b11-8+
InChIKey MBSCYYFTGCJCPI-DHZHZOJOSA-N
Molecular Weight 360.370 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15787
Solvent DMSO-d6
Source Vendor ID: NMR/11250408; Lab Info: LP; Lab Number: LP-1703159