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Calophyllolide
SpectraBase Compound ID 3KT4pjCMzQO
InChI InChI=1S/C26H24O5/c1-6-15(2)22(28)21-23(29-5)17-12-13-26(3,4)31-24(17)20-18(14-19(27)30-25(20)21)16-10-8-7-9-11-16/h6-14H,1-5H3/b15-6+
InChIKey PMBLOLOJQZPEND-GIDUJCDVSA-N
Mol Weight 416.47 g/mol
Molecular Formula C26H24O5
Exact Mass 416.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfZTMWuVcbX
Name Calophyllolide
Alternate Name(s) 5-Methoxy-2,2-dimethyl-6-[(E)-2-methyl-1-oxobut-2-enyl]-10-phenyl-8-pyrano[2,3-f][1]benzopyranone 5-Methoxy-2,2-dimethyl-6-[(E)-2-methylbut-2-enoyl]-10-phenyl-pyrano[2,3-f]chromen-8-one
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Formula C26H24O5
InChI InChI=1S/C26H24O5/c1-6-15(2)22(28)21-23(29-5)17-12-13-26(3,4)31-24(17)20-18(14-19(27)30-25(20)21)16-10-8-7-9-11-16/h6-14H,1-5H3/b15-6+
InChIKey PMBLOLOJQZPEND-GIDUJCDVSA-N
Molecular Weight 416.473 g/mol
SMILES c1(c2c(C(c3ccccc3)=CC(O2)=O)c2c(c1OC)C=CC(C)(C)O2)C(\C(=C\C)C)=O
SPLASH splash10-0udi-0001900000-5bff27bad798e697cdc9
Source of Spectrum KC-0-3146-1
Wiley ID 784687