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Benzoic acid, 2-bromo-3,5-dimethoxy-, 3,5-dimethoxybenzyl ester

View entire compound with spectra: 1 NMR

Benzoic acid, 2-bromo-3,5-dimethoxy-, 3,5-dimethoxybenzyl ester
SpectraBase Compound ID Ekx8MHcSLpQ
InChI InChI=1S/C18H19BrO6/c1-21-12-5-11(6-13(7-12)22-2)10-25-18(20)15-8-14(23-3)9-16(24-4)17(15)19/h5-9H,10H2,1-4H3
InChIKey JDTURECYCUYJDY-UHFFFAOYSA-N
Mol Weight 411.25 g/mol
Molecular Formula C18H19BrO6
Exact Mass 410.036501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Si7pSx243C
Name Benzoic acid, 2-bromo-3,5-dimethoxy-, 3,5-dimethoxybenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 410.036501326 u
Formula C18H19BrO6
InChI InChI=1S/C18H19BrO6/c1-21-12-5-11(6-13(7-12)22-2)10-25-18(20)15-8-14(23-3)9-16(24-4)17(15)19/h5-9H,10H2,1-4H3
InChIKey JDTURECYCUYJDY-UHFFFAOYSA-N
Molecular Weight 411.248 g/mol
SMILES C1(=CC(=CC(=C1Br)OC)OC)C(OCC1=CC(=CC(=C1)OC)OC)=O