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4-(3,4-Diacetoxybenzylidene)-2-phenyloxazol-5(4H)-one
SpectraBase Compound ID K6Ue1P7EoeO
InChI InChI=1S/C20H15NO6/c1-12(22)25-17-9-8-14(11-18(17)26-13(2)23)10-16-20(24)27-19(21-16)15-6-4-3-5-7-15/h3-11H,1-2H3/b16-10+
InChIKey LKTIYBGKWLNKGK-MHWRWJLKSA-N
Mol Weight 365.34 g/mol
Molecular Formula C20H15NO6
Exact Mass 365.089937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bl9VrCfTkiF
Name 4-(3,4-Diacetoxybenzylidene)-2-phenyloxazol-5(4H)-one
Comments Computed using HOSE algorithm
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Exact Mass 365.089937201 u
Formula C20H15NO6
InChI InChI=1S/C20H15NO6/c1-12(22)25-17-9-8-14(11-18(17)26-13(2)23)10-16-20(24)27-19(21-16)15-6-4-3-5-7-15/h3-11H,1-2H3/b16-10+
InChIKey LKTIYBGKWLNKGK-MHWRWJLKSA-N
Molecular Weight 365.341 g/mol
SMILES C1(=N\C(C(O1)=O)=C/C=1C=C(OC(=O)C)C(=CC1)OC(=O)C)C1=CC=CC=C1