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(E)-1-Allyl-5-[(E)-3-phenylallylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
SpectraBase Compound ID IImbT0x4coa
InChI InChI=1S/C16H14N2O3/c1-2-11-18-15(20)13(14(19)17-16(18)21)10-6-9-12-7-4-3-5-8-12/h2-10H,1,11H2,(H,17,19,21)/b9-6+,13-10+
InChIKey ANZNGTXTGAZNGD-DEKJKZHBSA-N
Mol Weight 282.3 g/mol
Molecular Formula C16H14N2O3
Exact Mass 282.100442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EV6oN1d0o07
Name (E)-1-Allyl-5-[(E)-3-phenylallylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Comments Computed using HOSE algorithm
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Exact Mass 282.100442316 u
Formula C16H14N2O3
InChI InChI=1S/C16H14N2O3/c1-2-11-18-15(20)13(14(19)17-16(18)21)10-6-9-12-7-4-3-5-8-12/h2-10H,1,11H2,(H,17,19,21)/b9-6+,13-10+
InChIKey ANZNGTXTGAZNGD-DEKJKZHBSA-N
Molecular Weight 282.299 g/mol
SMILES C1(NC(\C(C(N1CC=C)=O)=C/C=C/C1=CC=CC=C1)=O)=O