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Manuifolin E

View entire compound with spectra: 1 MS (GC)

Manuifolin E
SpectraBase Compound ID 6gTzyDk46lU
InChI InChI=1S/C25H30O4/c1-7-24(3,4)22-18-11-15(17-10-9-16(26)12-19(17)27)14-29-21(18)13-20(28)23(22)25(5,6)8-2/h7-10,12-13,15,26-28H,1-2,11,14H2,3-6H3
InChIKey TXBSIMMLQWELQA-UHFFFAOYSA-N
Mol Weight 394.51 g/mol
Molecular Formula C25H30O4
Exact Mass 394.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76oIEbHi9Gq
Name Manuifolin E
Alternate Name(s) 4-[5,6-bis(1,1-dimethyl-2-propenyl)-7-hydroxy-3,4-dihydro-2H-chromen-3-yl]-1,3-benzenediol 7-Hydroxy-3-[2'',4''-dihydroxyphenyl]-5',6-bis(1''',1'''-dimethyl-2'''-propenyl)-2,3-dihydrobenzopyran
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Formula C25H30O4
InChI InChI=1S/C25H30O4/c1-7-24(3,4)22-18-11-15(17-10-9-16(26)12-19(17)27)14-29-21(18)13-20(28)23(22)25(5,6)8-2/h7-10,12-13,15,26-28H,1-2,11,14H2,3-6H3
InChIKey TXBSIMMLQWELQA-UHFFFAOYSA-N
Molecular Weight 394.511 g/mol
SMILES Oc1ccc(c(c1)O)C1Cc2c(c(C(C=C)(C)C)c(cc2OC1)O)C(C=C)(C)C
SPLASH splash10-000f-1923000000-95eaf33409874dceaed1
Source of Spectrum G4-60-920-2
Wiley ID 1606860