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2-[2'-(Ethoxycarbonyl)-3'-oxocyclohex-1'-yl]-8-hydroxy-1,4-naphthoquinone
SpectraBase Compound ID LF9AHZHP0iM
InChI InChI=1S/C19H18O6/c1-2-25-19(24)17-10(5-3-8-14(17)21)12-9-15(22)11-6-4-7-13(20)16(11)18(12)23/h4,6-7,9-10,17,20H,2-3,5,8H2,1H3
InChIKey OIRGPBLQBGZOEV-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C19H18O6
Exact Mass 342.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6aCj0M7zhxg
Name 2-[2'-(Ethoxycarbonyl)-3'-oxocyclohex-1'-yl]-8-hydroxy-1,4-naphthoquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O6
InChI InChI=1S/C19H18O6/c1-2-25-19(24)17-10(5-3-8-14(17)21)12-9-15(22)11-6-4-7-13(20)16(11)18(12)23/h4,6-7,9-10,17,20H,2-3,5,8H2,1H3
InChIKey OIRGPBLQBGZOEV-UHFFFAOYSA-N
Molecular Weight 342.347 g/mol
SMILES Oc1c2C(C(C3C(C(=O)OCC)C(=O)CCC3)=CC(c2ccc1)=O)=O
SPLASH splash10-0005-0190000000-c3434cdbe8742c9c8da0
Source of Spectrum K1-2000-1981-8
Synonyms Ethyl 2-(8-hydroxy-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-6-oxocyclohexanecarboxylate
Wiley ID 750436