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8-C-METHYL-7-O-PRENYLPINOCEMBRIN
SpectraBase Compound ID 9IOHDtuvNR2
InChI InChI=1S/C21H22O4/c1-13(2)9-10-24-18-11-16(22)20-17(23)12-19(25-21(20)14(18)3)15-7-5-4-6-8-15/h4-9,11,19,22H,10,12H2,1-3H3/t19-/m0/s1
InChIKey NMCPIRNLKGZEMU-IBGZPJMESA-N
Mol Weight 338.4 g/mol
Molecular Formula C21H22O4
Exact Mass 338.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55YIlEN52uA
Name 8-c-methyl-7-O-prenyl-pinodecembrin
Alternate Name(s) (2S)-5-hydroxy-8-methyl-7-(3-methylbut-2-enoxy)-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one (2S)-5-hydroxy-8-methyl-7-(3-methylbut-2-enoxy)-2-phenyl-2,3-dihydrochromen-4-one (2S)-8-methyl-7-(3-methylbut-2-enoxy)-5-oxidanyl-2-phenyl-2,3-dihydrochromen-4-one
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Formula C21H22O4
InChI InChI=1S/C21H22O4/c1-13(2)9-10-24-18-11-16(22)20-17(23)12-19(25-21(20)14(18)3)15-7-5-4-6-8-15/h4-9,11,19,22H,10,12H2,1-3H3/t19-/m0/s1
InChIKey NMCPIRNLKGZEMU-IBGZPJMESA-N
Molecular Weight 338.403 g/mol
SMILES Oc1c2c(O[C@@](CC2=O)(c2ccccc2)[H])c(c(c1)OCC=C(C)C)C
SPLASH splash10-01bi-6951000000-de91c725eb758acf4ccb
Source of Spectrum X2-49-155-2
Wiley ID 1601800