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2-(4,7-Dimethyl-(1.alpha.H),2,3,(4.beta.H),(4a.alpha..H),5,8,(8a.alpha.H)-octahydronaphthalen-1-yl)propionic acid [.deata.3-dihydroartemisinic acid isomer]
SpectraBase Compound ID 87aFG6og4yH
InChI InChI=1S/C15H24O2/c1-9-4-6-12-10(2)5-7-13(14(12)8-9)11(3)15(16)17/h8,10-14H,4-7H2,1-3H3,(H,16,17)/t10-,11-,12+,13+,14+/m1/s1
InChIKey JYGAZEJXUVDYHI-DGTMBMJNSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KcEABhlUL3R
Name 2-(4,7-Dimethyl-(1.alpha.H),2,3,(4.beta.H),(4a.alpha..H),5,8,(8a.alpha.H)-octahydronaphthalen-1-yl)propionic acid [.deata.3-dihydroartemisinic acid isomer]
Alternate Name(s) Dihydro-artemisinic acid 1,6-Dimethyl-4-[1'-(hydroxycarbonyl)ehtyl]-1,2,3,4,7,8,9,10-octahydronaphthalene (2R)-2-[(1R,4R,4aS,8aS)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]propanoic acid
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Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-9-4-6-12-10(2)5-7-13(14(12)8-9)11(3)15(16)17/h8,10-14H,4-7H2,1-3H3,(H,16,17)/t10-,11-,12+,13+,14+/m1/s1
InChIKey JYGAZEJXUVDYHI-DGTMBMJNSA-N
Molecular Weight 236.355 g/mol
SMILES OC([C@@]([C@]1([C@@]2([C@@](CCC(=C2)C)([C@@](CC1)(C)[H])[H])[H])[H])(C)[H])=O
SPLASH splash10-03di-8900000000-92fc7ab879ee448efdf1
Source of Spectrum G4-62-432-2
Wiley ID 1607794