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PARATOCARPIN-A
SpectraBase Compound ID 5yWoGSlUSD5
InChI InChI=1S/C25H24O4/c1-24(2)13-11-17-15-16(6-9-21(17)28-24)5-8-20(26)18-7-10-22-19(23(18)27)12-14-25(3,4)29-22/h5-15,27H,1-4H3/b8-5+
InChIKey QGPHHWRNFMTVGA-VMPITWQZSA-N
Mol Weight 388.46 g/mol
Molecular Formula C25H24O4
Exact Mass 388.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkhwkBTI8nd
Name (E)-3-(2,2-dimethyl-1-benzopyran-6-yl)-1-(5-hydroxy-2,2-dimethyl-1-benzopyran-6-yl)-2-propen-1-one
Alternate Name(s) (E)-3-(2,2-dimethylchromen-6-yl)-1-(2,2-dimethyl-5-oxidanyl-chromen-6-yl)prop-2-en-1-one (E)-3-(2,2-dimethylchromen-6-yl)-1-(5-hydroxy-2,2-dimethyl-chromen-6-yl)prop-2-en-1-one
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Formula C25H24O4
InChI InChI=1S/C25H24O4/c1-24(2)13-11-17-15-16(6-9-21(17)28-24)5-8-20(26)18-7-10-22-19(23(18)27)12-14-25(3,4)29-22/h5-15,27H,1-4H3/b8-5+
InChIKey QGPHHWRNFMTVGA-VMPITWQZSA-N
Molecular Weight 388.463 g/mol
SMILES Oc1c2c(OC(C=C2)(C)C)ccc1C(\C=C\c1cc2C=CC(Oc2cc1)(C)C)=O
SPLASH splash10-00di-0709000000-983164e12392e5abd4f2
Source of Spectrum H1-41-197-1
Wiley ID 757047