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LEOPERSIN-G

View entire compound with spectra: 1 NMR, and 1 MS (GC)

LEOPERSIN-G
SpectraBase Compound ID 46S2Y5KRM6O
InChI InChI=1S/C20H30O4/c1-13-15(21)11-16-18(2,3)7-5-8-19(16,4)20(13,23)9-6-14-10-17(22)24-12-14/h10,13,16,23H,5-9,11-12H2,1-4H3/t13-,16+,19+,20-/m1/s1
InChIKey WQXSVWJEQLFYJT-UNGRWJMUSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MPx0IWtNo
Name 3-[2-[(1R,2S,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyl-3-oxo-2,4,4a,6,7,8-hexahydronaphthalen-1-yl]ethyl]-2H-furan-5-one
Alternate Name(s) 3-[2-[(1R,2S,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyl-3-oxo-decalin-1-yl]ethyl]-2H-furan-5-one 3-[2-[(1R,2S,4aS,8aS)-1-hydroxy-3-keto-2,5,5,8a-tetramethyl-decalin-1-yl]ethyl]-2H-furan-5-one 3-[2-[(1R,2S,4aS,8aS)-2,5,5,8a-tetramethyl-1-oxidanyl-3-oxidanylidene-2,4,4a,6,7,8-hexahydronaphthalen-1-yl]ethyl]-2H-furan-5-one
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Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-13-15(21)11-16-18(2,3)7-5-8-19(16,4)20(13,23)9-6-14-10-17(22)24-12-14/h10,13,16,23H,5-9,11-12H2,1-4H3/t13-,16+,19+,20-/m1/s1
InChIKey WQXSVWJEQLFYJT-UNGRWJMUSA-N
Molecular Weight 334.456 g/mol
SMILES O[C@]1([C@@]2([C@@](C(C)(C)CCC2)([H])CC([C@]1(C)[H])=O)C)CCC1=CC(=O)OC1
SPLASH splash10-03di-0971000000-373f991dfe89e1970fa1
Source of Spectrum G4-60-878-1
Wiley ID 1606833