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2-(2,4-Dichlorophenoxy)-5-ethoxycarbonyl-6-methyl-3-phenylfuro[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID F7g1K29EwFZ
InChI InChI=1S/C22H16Cl2N2O5/c1-3-29-21(28)17-12(2)30-19-18(17)20(27)26(14-7-5-4-6-8-14)22(25-19)31-16-10-9-13(23)11-15(16)24/h4-11H,3H2,1-2H3
InChIKey YTKOKZREQGABLX-UHFFFAOYSA-N
Mol Weight 459.29 g/mol
Molecular Formula C22H16Cl2N2O5
Exact Mass 458.043627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlNqk59lFgB
Name 2-(2,4-Dichlorophenoxy)-5-ethoxycarbonyl-6-methyl-3-phenylfuro[2,3-d]pyrimidin-4(3H)-one
Appearance White crystals
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Formula C22H16Cl2N2O5
InChI InChI=1S/C22H16Cl2N2O5/c1-3-29-21(28)17-12(2)30-19-18(17)20(27)26(14-7-5-4-6-8-14)22(25-19)31-16-10-9-13(23)11-15(16)24/h4-11H,3H2,1-2H3
InChIKey YTKOKZREQGABLX-UHFFFAOYSA-N
Instrument Name Finnigan Trace
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.d18
Molecular Weight 459.285 g/mol
SMILES c1(Cl)cc(c(cc1)OC=1N(C(c2c(N1)oc(c2C(=O)OCC)C)=O)c1ccccc1)Cl
SPLASH splash10-00kb-0690400000-615072db55f23583908f
Source of Spectrum ARK-2008-157-6m
Wiley ID 1869117