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ELISABETHIN_B
SpectraBase Compound ID L30zlpK641s
InChI InChI=1S/C19H28O2/c1-11(2)9-15-10-14(6)16-8-7-13(5)18(21)19(15,16)17(20)12(3)4/h9,13-16H,3,7-8,10H2,1-2,4-6H3/t13-,14-,15+,16+,19-/m0/s1
InChIKey PWDIOLQNQGTASX-DBDOFBCQSA-N
Mol Weight 288.43 g/mol
Molecular Formula C19H28O2
Exact Mass 288.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBUVMNNYZtE
Name Elisabethin B
Alternate Name(s) (1S,3S,3aR,5S,7aR)-3a-methacryloyl-1,5-dimethyl-3-(2-methyl-1-propenyl)octahydro-4H-inden-4-one (1S,3S,3aS,5S,7aR)-1,5-dimethyl-3a-(2-methyl-1-oxoprop-2-enyl)-3-(2-methylprop-1-enyl)-2,3,5,6,7,7a-hexahydro-1H-inden-4-one (1S,3S,3aS,5S,7aR)-1,5-dimethyl-3a-(2-methylprop-2-enoyl)-3-(2-methylprop-1-enyl)-2,3,5,6,7,7a-hexahydro-1H-inden-4-one
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Formula C19H28O2
InChI InChI=1S/C19H28O2/c1-11(2)9-15-10-14(6)16-8-7-13(5)18(21)19(15,16)17(20)12(3)4/h9,13-16H,3,7-8,10H2,1-2,4-6H3/t13-,14-,15+,16+,19-/m0/s1
InChIKey PWDIOLQNQGTASX-DBDOFBCQSA-N
Molecular Weight 288.431 g/mol
SMILES [C@]12([C@](C=C(C)C)(C[C@@]([C@]2(CC[C@@](C1=O)(C)[H])[H])(C)[H])[H])C(C(=C)C)=O
SPLASH splash10-014i-3590000000-76c899e73e7e6f2fe1a9
Source of Spectrum J-63-7090-2
Wiley ID 1292124