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7H-Furo[3,2-g][1]benzopyran-7-one, 9-[2-(acetyloxy)-4-(2,5-dihydro-4-methyl-5-oxo-2-furanyl)-3-hydroxy-3-methylbutoxy]-
SpectraBase Compound ID 4ySI3vwoSf8
InChI InChI=1S/C23H22O9/c1-12-8-16(31-22(12)26)10-23(3,27)17(30-13(2)24)11-29-21-19-15(6-7-28-19)9-14-4-5-18(25)32-20(14)21/h4-9,16-17,27H,10-11H2,1-3H3
InChIKey PVRODIMEZXVZJC-UHFFFAOYSA-N
Mol Weight 442.42 g/mol
Molecular Formula C23H22O9
Exact Mass 442.126382 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 664mdjHrujF
Name 7H-Furo[3,2-g][1]benzopyran-7-one, 9-[2-(acetyloxy)-4-(2,5-dihydro-4-methyl-5-oxo-2-furanyl)-3-hydroxy-3-methylbutoxy]-
CAS Registry Number 68725-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O9
InChI InChI=1S/C23H22O9/c1-12-8-16(31-22(12)26)10-23(3,27)17(30-13(2)24)11-29-21-19-15(6-7-28-19)9-14-4-5-18(25)32-20(14)21/h4-9,16-17,27H,10-11H2,1-3H3
InChIKey PVRODIMEZXVZJC-UHFFFAOYSA-N
Molecular Weight 442.420 g/mol
SMILES OC(C(COc1c2OC(=O)C=Cc2cc2c1occ2)OC(=O)C)(CC1OC(=O)C(=C1)C)C
SPLASH splash10-0uka-4890100000-3af926e3e20fc8cff83e
Source of Spectrum W5-35236-30300-30300
Synonyms 3-Hydroxy-3-[(4-methyl-5-oxo-2,5-dihydrofuran-2-yl)methyl]-1-({2-oxo-2H-furo[3,2-g]chromen-9-yl}oxy)butan-2-yl acetate Acetic acid [3-hydroxy-3-methyl-4-(4-methyl-5-oxo-2H-furan-2-yl)-1-[(7-oxo-9-furo[3,2-g][1]benzopyranyl)oxy]butan-2-yl] ester [3-hydroxy-3-methyl-4-(4-methyl-5-oxo-2H-furan-2-yl)-1-(7-oxofuro[3,2-g]chromen-9-yl)oxybutan-2-yl] acetate [2-hydroxy-2-methyl-3-(4-methyl-5-oxo-2H-furan-2-yl)-1-[(7-oxofuro[3,2-g]chromen-9-yl)oxymethyl]propyl] acetate [3-methyl-4-(4-methyl-5-oxidanylidene-2H-furan-2-yl)-3-oxidanyl-1-(7-oxidanylidenefuro[3,2-g]chromen-9-yl)oxy-butan-2-yl] ethanoate
Wiley ID 1385260