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Acetic acid 2-(5-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-1-(4-methoxyphenyl)ethyl ester
SpectraBase Compound ID ENQXuWOyz7H
InChI InChI=1S/C21H18O6/c1-12(22)27-19(13-6-8-15(26-2)9-7-13)11-14-10-18(24)20-16(21(14)25)4-3-5-17(20)23/h3-10,19,23H,11H2,1-2H3
InChIKey JOJYFEQWAKZZSK-UHFFFAOYSA-N
Mol Weight 366.37 g/mol
Molecular Formula C21H18O6
Exact Mass 366.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lr0CRiIKszk
Name Acetic acid 2-(5-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-1-(4-methoxyphenyl)ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O6
InChI InChI=1S/C21H18O6/c1-12(22)27-19(13-6-8-15(26-2)9-7-13)11-14-10-18(24)20-16(21(14)25)4-3-5-17(20)23/h3-10,19,23H,11H2,1-2H3
InChIKey JOJYFEQWAKZZSK-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo202448e
Molecular Weight 366.369 g/mol
SMILES Oc1c2C(=O)C=C(C(c2ccc1)=O)CC(c1ccc(cc1)OC)OC(=O)C
SPLASH splash10-000i-1903000000-cae45209da563932b660
Source of Spectrum J-77-2663-4e
Synonyms 2-(5-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-1-(4-methoxyphenyl)ethyl acetate Acetic acid [2-(5-hydroxy-1,4-dioxo-2-naphthalenyl)-1-(4-methoxyphenyl)ethyl] ester [2-(5-hydroxy-1,4-dioxonaphthalen-2-yl)-1-(4-methoxyphenyl)ethyl] acetate [2-(5-hydroxy-1,4-dioxo-2-naphthyl)-1-(4-methoxyphenyl)ethyl] acetate [1-(4-methoxyphenyl)-2-[5-oxidanyl-1,4-bis(oxidanylidene)naphthalen-2-yl]ethyl] ethanoate
Wiley ID 1744990