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5,8-Dihydroxy-2-[1'-(.beta.,.beta.-dimethylacryloyloxy)-4'-acetoxy-4'-methylpentyl]-1,4-naphthalenedione
SpectraBase Compound ID 2hRbDIxBOH1
InChI InChI=1S/C23H26O8/c1-12(2)10-19(28)30-18(8-9-23(4,5)31-13(3)24)14-11-17(27)20-15(25)6-7-16(26)21(20)22(14)29/h6-7,10-11,18,25-26H,8-9H2,1-5H3
InChIKey VJQGQBYIBPXPDD-UHFFFAOYSA-N
Mol Weight 430.45 g/mol
Molecular Formula C23H26O8
Exact Mass 430.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fKT7HqlcXF
Name 5,8-Dihydroxy-2-[1'-(.beta.,.beta.-dimethylacryloyloxy)-4'-acetoxy-4'-methylpentyl]-1,4-naphthalenedione
Alternate Name(s) 4-(acetyloxy)-1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-4-methylpentyl 3-methyl-2-butenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26O8
InChI InChI=1S/C23H26O8/c1-12(2)10-19(28)30-18(8-9-23(4,5)31-13(3)24)14-11-17(27)20-15(25)6-7-16(26)21(20)22(14)29/h6-7,10-11,18,25-26H,8-9H2,1-5H3
InChIKey VJQGQBYIBPXPDD-UHFFFAOYSA-N
Molecular Weight 430.453 g/mol
SMILES Oc1c2C(C=C(C(c2c(cc1)O)=O)C(OC(C=C(C)C)=O)CCC(OC(=O)C)(C)C)=O
SPLASH splash10-05fr-0090000000-65e82ca74c200d46a399
Source of Spectrum X2-50-619-1
Wiley ID 1602296