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5-[3-(4-Benzyl-2-methoxyphenyl)-1-oxoprop-2-en-1-yl]-2H-[1,3]benzo[b]dioxole
SpectraBase Compound ID DlTHpZKH76S
InChI InChI=1S/C24H20O4/c1-26-23-14-18(13-17-5-3-2-4-6-17)7-8-19(23)9-11-21(25)20-10-12-22-24(15-20)28-16-27-22/h2-12,14-15H,13,16H2,1H3/b11-9-
InChIKey ZLYWFDKEAXKKEK-LUAWRHEFSA-N
Mol Weight 372.42 g/mol
Molecular Formula C24H20O4
Exact Mass 372.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wHsAwr1N7A
Name 5-[3-(4-Benzyl-2-methoxyphenyl)-1-oxoprop-2-en-1-yl]-2H-[1,3]benzo[b]dioxole
Comments Note: The molecular formula of the structure shown is C24H20O4 - which differs from the formula reported for the mass spectrum (C24H20O5)
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Formula C24H20O5
InChI InChI=1S/C24H20O4/c1-26-23-14-18(13-17-5-3-2-4-6-17)7-8-19(23)9-11-21(25)20-10-12-22-24(15-20)28-16-27-22/h2-12,14-15H,13,16H2,1H3/b11-9-
InChIKey ZLYWFDKEAXKKEK-LUAWRHEFSA-N
Molecular Weight 372.420 g/mol
SMILES c1(\C=C/C(c2cc3OCOc3cc2)=O)c(cc(cc1)Cc1ccccc1)OC
SPLASH splash10-0006-9102000000-2ab35f13a0659f26296b
Source of Spectrum O1-31-1634-11
Wiley ID 818944