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5-[(E)-2-(4-NITROPHENYL)-ETHENYL]-1,3-DIOCTYL-URACIL

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5-[(E)-2-(4-NITROPHENYL)-ETHENYL]-1,3-DIOCTYL-URACIL
SpectraBase Compound ID 950ZlIxAyjZ
InChI InChI=1S/C28H41N3O4/c1-3-5-7-9-11-13-21-29-23-25(18-15-24-16-19-26(20-17-24)31(34)35)27(32)30(28(29)33)22-14-12-10-8-6-4-2/h15-20,23H,3-14,21-22H2,1-2H3/b18-15+
InChIKey VRTILKBFXOEDME-OBGWFSINSA-N
Mol Weight 483.7 g/mol
Molecular Formula C28H41N3O4
Exact Mass 483.309707 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HB8N9ScSN6Y
Name 5-[(E)-2-(4-NITROPHENYL)-ETHENYL]-1,3-DIOCTYL-URACIL
Compound Number 10C-(E)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H41N3O4
InChI InChI=1S/C28H41N3O4/c1-3-5-7-9-11-13-21-29-23-25(18-15-24-16-19-26(20-17-24)31(34)35)27(32)30(28(29)33)22-14-12-10-8-6-4-2/h15-20,23H,3-14,21-22H2,1-2H3/b18-15+
InChIKey VRTILKBFXOEDME-OBGWFSINSA-N
Literature Reference Author E.COUTOULI-ARGYROPOULOU,C.ZACHARIADOU
Literature Reference Citation J.HETCYCL.CHEM.,42,1135(2005)
Literature Reference DOI 10.1002/jhet.5570420615
Molecular Weight 483.651 g/mol
Sample ID 42222
Solvent CDCl3