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4-(4-BrOMOBENZOYL)-3-[N-(6-AMINO-3,5-DIMETHYLURACIL)-AMINO]-2(5H)-FURANONE
SpectraBase Compound ID 205fQ2Jxd80
InChI InChI=1S/C17H15BrN4O5/c1-21-14(19)12(15(24)22(2)17(21)26)20-11-10(7-27-16(11)25)13(23)8-3-5-9(18)6-4-8/h3-6,20H,7,19H2,1-2H3
InChIKey QCYUACYRJKWSED-UHFFFAOYSA-N
Mol Weight 435.23 g/mol
Molecular Formula C17H15BrN4O5
Exact Mass 434.022583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kq2qGSOABFA
Name 4-(4-BrOMOBENZOYL)-3-[N-(6-AMINO-3,5-DIMETHYLURACIL)-AMINO]-2(5H)-FURANONE
Compound Number 7D
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Formula C17H15BrN4O5
InChI InChI=1S/C17H15BrN4O5/c1-21-14(19)12(15(24)22(2)17(21)26)20-11-10(7-27-16(11)25)13(23)8-3-5-9(18)6-4-8/h3-6,20H,7,19H2,1-2H3
InChIKey QCYUACYRJKWSED-UHFFFAOYSA-N
Literature Reference Author H.ZIMMER,A.AMER,D.HO,R.PALMER-SUNGAIL
Literature Reference Citation J.HETCYCL.CHEM.,28,1501(1991)
Literature Reference DOI 10.1002/jhet.5570280606
Molecular Weight 435.234 g/mol
Solvent DMSO-D6
Source File Reference UWCP709