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Acetic acid 7-((E)-3,7-dimethyl-octa-2,6-dienyloxy)-3-hydroxy-9-oxo-9H-xanthen-1-yl ester
SpectraBase Compound ID 1rm91xs2oZ1
InChI InChI=1S/C25H26O6/c1-15(2)6-5-7-16(3)10-11-29-19-8-9-21-20(14-19)25(28)24-22(30-17(4)26)12-18(27)13-23(24)31-21/h6,8-10,12-14,27H,5,7,11H2,1-4H3/b16-10+
InChIKey WCLSIYZEDUYDKO-MHWRWJLKSA-N
Mol Weight 422.48 g/mol
Molecular Formula C25H26O6
Exact Mass 422.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0aAUhrTfDL
Name Acetic acid 7-((E)-3,7-dimethyl-octa-2,6-dienyloxy)-3-hydroxy-9-oxo-9H-xanthen-1-yl ester
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Formula C25H26O6
InChI InChI=1S/C25H26O6/c1-15(2)6-5-7-16(3)10-11-29-19-8-9-21-20(14-19)25(28)24-22(30-17(4)26)12-18(27)13-23(24)31-21/h6,8-10,12-14,27H,5,7,11H2,1-4H3/b16-10+
InChIKey WCLSIYZEDUYDKO-MHWRWJLKSA-N
Molecular Weight 422.477 g/mol
SMILES Oc1cc(c2C(c3cc(OC\C=C\(CCC=C(C)C)C)ccc3Oc2c1)=O)OC(=O)C
SPLASH splash10-0006-2090000000-090bf4aa9b685797463d
Source of Spectrum F-65-3011-13
Synonyms Cochinchinone L Acetic acid [7-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-hydroxy-9-oxo-1-xanthenyl] ester [7-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-hydroxy-9-oxoxanthen-1-yl] acetate [7-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-hydroxy-9-oxo-xanthen-1-yl] acetate [7-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-oxidanyl-9-oxidanylidene-xanthen-1-yl] ethanoate
Wiley ID 1681274