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1-[2'-Hydroxy-3',4'-(methylenedioxy)-5'-methoxyphenyl}-2-(2"-bromo-5"-benzyloxy)-ethane

View entire compound with spectra: 1 MS (GC)

1-[2'-Hydroxy-3',4'-(methylenedioxy)-5'-methoxyphenyl}-2-(2"-bromo-5"-benzyloxy)-ethane
SpectraBase Compound ID 2tinMFB2mrQ
InChI InChI=1S/C23H21BrO5/c1-26-20-12-17(21(25)23-22(20)28-14-29-23)8-7-16-11-18(9-10-19(16)24)27-13-15-5-3-2-4-6-15/h2-6,9-12,25H,7-8,13-14H2,1H3
InChIKey DBLVPXYRLVCCJY-UHFFFAOYSA-N
Mol Weight 457.32 g/mol
Molecular Formula C23H21BrO5
Exact Mass 456.057237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHFJkzqX6Hs
Name 1-[2'-Hydroxy-3',4'-(methylenedioxy)-5'-methoxyphenyl}-2-(2"-bromo-5"-benzyloxy)-ethane
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Formula C23H21BrO5
InChI InChI=1S/C23H21BrO5/c1-26-20-12-17(21(25)23-22(20)28-14-29-23)8-7-16-11-18(9-10-19(16)24)27-13-15-5-3-2-4-6-15/h2-6,9-12,25H,7-8,13-14H2,1H3
InChIKey DBLVPXYRLVCCJY-UHFFFAOYSA-N
Molecular Weight 457.320 g/mol
SMILES Oc1c2c(c(cc1CCc1c(ccc(c1)OCc1ccccc1)Br)OC)OCO2
SPLASH splash10-0006-9000000000-50756efb53359125cc5b
Source of Spectrum G4-71-1941-18
Synonyms 5-[2-(2-bromo-5-phenylmethoxyphenyl)ethyl]-7-methoxy-1,3-benzodioxol-4-ol 5-[2-(5-benzyloxy-2-bromo-phenyl)ethyl]-7-methoxy-1,3-benzodioxol-4-ol 5-[2-(2-bromanyl-5-phenylmethoxy-phenyl)ethyl]-7-methoxy-1,3-benzodioxol-4-ol
Wiley ID 1695211