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N3-(3,5-DINITROBENZOYL)-THYMINE
SpectraBase Compound ID 9oSwqaChnmI
InChI InChI=1S/C12H8N4O7/c1-6-5-13-12(19)14(10(6)17)11(18)7-2-8(15(20)21)4-9(3-7)16(22)23/h2-5H,1H3,(H,13,19)
InChIKey GUICTOBTPWIYJD-UHFFFAOYSA-N
Mol Weight 320.22 g/mol
Molecular Formula C12H8N4O7
Exact Mass 320.039299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1bIUaKK2Zsk
Name N3-(3,5-DINITROBENZOYL)-THYMINE
Compound Number 8D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H8N4O7
InChI InChI=1S/C12H8N4O7/c1-6-5-13-12(19)14(10(6)17)11(18)7-2-8(15(20)21)4-9(3-7)16(22)23/h2-5H,1H3,(H,13,19)
InChIKey GUICTOBTPWIYJD-UHFFFAOYSA-N
Literature Reference Author O.R.LUDEK,C.MEIER
Literature Reference Citation EUR.J.ORG.CHEM.,941(2006)
Molecular Weight 320.218 g/mol
Sample ID 43207
Solvent DMSO-D6