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Parthenolide
SpectraBase Compound ID BWp2BdQKIEL
InChI InChI=1S/C15H20O3/c1-9-5-4-8-15(3)13(18-15)12-11(7-6-9)10(2)14(16)17-12/h5,11-13H,2,4,6-8H2,1,3H3/b9-5-
InChIKey KTEXNACQROZXEV-UITAMQMPSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KcPGCW173XG
Name Parthenolide
Alternate Name(s) 1a,5-Dimethyl-8-methylene-2,3,6,7,7a,8,10a,10b-octahydrooxireno[2',3':9,10]cyclodeca[1,2-b]furan-9(1ah)-one
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Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-9-5-4-8-15(3)13(18-15)12-11(7-6-9)10(2)14(16)17-12/h5,11-13H,2,4,6-8H2,1,3H3/b9-5-
InChIKey KTEXNACQROZXEV-UITAMQMPSA-N
Molecular Weight 248.322 g/mol
SMILES C12OC2(CC\C=C/(CCC2C(=C)C(OC12)=O)C)C
SPLASH splash10-0k9y-9600000000-672f71399e17d64e420c
Source of Spectrum X2-56-96-1
Wiley ID 1604693