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3-(4-Methoxybenzyl)-4-oxochromane-5,7-diyl diacetate

View entire compound with spectra: 1 NMR

3-(4-Methoxybenzyl)-4-oxochromane-5,7-diyl diacetate
SpectraBase Compound ID 7VpTeFI2iNF
InChI InChI=1S/C21H20O7/c1-12(22)27-17-9-18-20(19(10-17)28-13(2)23)21(24)15(11-26-18)8-14-4-6-16(25-3)7-5-14/h4-7,9-10,15H,8,11H2,1-3H3
InChIKey ZOIMBEGLQVZHCS-UHFFFAOYSA-N
Mol Weight 384.38 g/mol
Molecular Formula C21H20O7
Exact Mass 384.120903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DbsLngS9LRf
Name 3-(4-Methoxybenzyl)-4-oxochromane-5,7-diyl diacetate
Comments Computed using HOSE algorithm
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Exact Mass 384.120902977 u
Formula C21H20O7
InChI InChI=1S/C21H20O7/c1-12(22)27-17-9-18-20(19(10-17)28-13(2)23)21(24)15(11-26-18)8-14-4-6-16(25-3)7-5-14/h4-7,9-10,15H,8,11H2,1-3H3
InChIKey ZOIMBEGLQVZHCS-UHFFFAOYSA-N
Molecular Weight 384.384 g/mol
SMILES C1=C(C=C2OCC(C(C2=C1OC(C)=O)=O)CC=1C=CC(=CC1)OC)OC(C)=O