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2-[2'-(Ethoxycarbonyl)-3'-hydroxy cyclohex-1'-yl]-1,4-naphthoquinone
SpectraBase Compound ID IS2jQRH6JSw
InChI InChI=1S/C19H18O5/c1-2-24-19(23)17-12(8-5-9-15(17)20)14-10-16(21)11-6-3-4-7-13(11)18(14)22/h3-4,6-7,10,12,20H,2,5,8-9H2,1H3
InChIKey WFWANTNJOGXBMP-UHFFFAOYSA-N
Mol Weight 326.35 g/mol
Molecular Formula C19H18O5
Exact Mass 326.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ga5hi4VvUkF
Name 2-[2'-(Ethoxycarbonyl)-3'-hydroxy cyclohex-1'-yl]-1,4-naphthoquinone
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Formula C19H18O5
InChI InChI=1S/C19H18O5/c1-2-24-19(23)17-12(8-5-9-15(17)20)14-10-16(21)11-6-3-4-7-13(11)18(14)22/h3-4,6-7,10,12,20H,2,5,8-9H2,1H3
InChIKey WFWANTNJOGXBMP-UHFFFAOYSA-N
Molecular Weight 326.348 g/mol
SMILES OC1=C(C(C=2C(c3ccccc3C(C2)=O)=O)CCC1)C(=O)OCC
SPLASH splash10-0ul1-0490000000-227393c1dad39028cfb6
Source of Spectrum K1-2000-1980-8
Synonyms 2-[2'-(Ethoxycarbonyl)-3'-hydroxycyclohex-2-ene-1'-yl]-1,4-naphthoquinone 2-[2'-(Ethoxycarbonyl)-3'-oxocyclohex-1'-yl]-1,4-naphthoquinone Ethyl 6-(1,4-dioxo-1,4-dihydro-2-naphthalenyl)-2-hydroxy-1-cyclohexene-1-carboxylate 6-(1,4-dioxo-2-naphthalenyl)-2-hydroxy-1-cyclohexenecarboxylic acid ethyl ester Ethyl 6-(1,4-dioxonaphthalen-2-yl)-2-hydroxycyclohexene-1-carboxylate Ethyl 6-(1,4-dioxo-2-naphthyl)-2-hydroxy-cyclohexene-1-carboxylate Ethyl 6-[1,4-bis(oxidanylidene)naphthalen-2-yl]-2-oxidanyl-cyclohexene-1-carboxylate
Wiley ID 750438