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5-HYDROXY-2-(2-METHYLALLYL)-3-[4-(2-METHYL-1,3-DIOXOLAN-2-YL)-3-OXOBUTYL]-[1.4]-NAPHTHOQUINONE
SpectraBase Compound ID 7J1w4TpO9Gb
InChI InChI=1S/C22H24O6/c1-13(2)11-17-15(8-7-14(23)12-22(3)27-9-10-28-22)21(26)19-16(20(17)25)5-4-6-18(19)24/h4-6,24H,1,7-12H2,2-3H3
InChIKey LPRQCOZACWAWFE-UHFFFAOYSA-N
Mol Weight 384.43 g/mol
Molecular Formula C22H24O6
Exact Mass 384.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9bQ6vb3K4xn
Name 3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxidanylidene-butyl]-2-(2-methylprop-2-enyl)-5-oxidanyl-naphthalene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O6
InChI InChI=1S/C22H24O6/c1-13(2)11-17-15(8-7-14(23)12-22(3)27-9-10-28-22)21(26)19-16(20(17)25)5-4-6-18(19)24/h4-6,24H,1,7-12H2,2-3H3
InChIKey LPRQCOZACWAWFE-UHFFFAOYSA-N
Molecular Weight 384.428 g/mol
SMILES Oc1c2c(C(C(=C(C2=O)CCC(CC2(OCCO2)C)=O)CC(=C)C)=O)ccc1
SPLASH splash10-000i-9050000000-45ab8b21db35a6c5d722
Source of Spectrum J-62-2354-11
Synonyms 5-Hydroxy-2-(2-methylallyl)-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxo-butyl]naphthalene-1,4-dione 5-Hydroxy-3-[3-keto-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-2-(2-methylallyl)-1,4-naphthoquinone 5-Hydroxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxobutyl]-2-(2-methylprop-2-enyl)naphthalene-1,4-dione
Wiley ID 1361632