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3,5-Diacetyl-4-ethoxy-2,6-bis[4'-(methoxyphenoxy)methyl]phenol
SpectraBase Compound ID A2tEjGJohV6
InChI InChI=1S/C28H30O8/c1-6-34-28-25(17(2)29)23(15-35-21-11-7-19(32-4)8-12-21)27(31)24(26(28)18(3)30)16-36-22-13-9-20(33-5)10-14-22/h7-14,31H,6,15-16H2,1-5H3
InChIKey ORYUAISZRGYRIR-UHFFFAOYSA-N
Mol Weight 494.54 g/mol
Molecular Formula C28H30O8
Exact Mass 494.194068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9d5ZMjqCUAI
Name 3,5-Diacetyl-4-ethoxy-2,6-bis[4'-(methoxyphenoxy)methyl]phenol
Comments Computed using HOSE algorithm
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Exact Mass 494.194067918 u
Formula C28H30O8
InChI InChI=1S/C28H30O8/c1-6-34-28-25(17(2)29)23(15-35-21-11-7-19(32-4)8-12-21)27(31)24(26(28)18(3)30)16-36-22-13-9-20(33-5)10-14-22/h7-14,31H,6,15-16H2,1-5H3
InChIKey ORYUAISZRGYRIR-UHFFFAOYSA-N
Molecular Weight 494.540 g/mol
SMILES C=1(C(=C(OCC)C(=C(C1O)COC=1C=CC(=CC1)OC)C(=O)C)C(=O)C)COC=1C=CC(=CC1)OC