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5-(Hydroxy)-2,3,6-trimethyl-2-[2-(5-oxodihydrofuran-3-yl)ethyl]bicyclo[4.4.0]decan-7-carboxylic acid
SpectraBase Compound ID LsKV2kOQJnc
InChI InChI=1S/C20H30O5/c1-12-9-16(21)20(3)14(18(23)24)5-4-6-15(20)19(12,2)8-7-13-10-17(22)25-11-13/h10,12,14-16,21H,4-9,11H2,1-3H3,(H,23,24)/t12-,14-,15-,16+,19+,20-/m1/s1
InChIKey WNMPYAFMEIPUEI-YTXRDGOUSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8smQgCUDLSw
Name 5-(Hydroxy)-2,3,6-trimethyl-2-[2-(5-oxodihydrofuran-3-yl)ethyl]bicyclo[4.4.0]decan-7-carboxylic acid
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Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-12-9-16(21)20(3)14(18(23)24)5-4-6-15(20)19(12,2)8-7-13-10-17(22)25-11-13/h10,12,14-16,21H,4-9,11H2,1-3H3,(H,23,24)/t12-,14-,15-,16+,19+,20-/m1/s1
InChIKey WNMPYAFMEIPUEI-YTXRDGOUSA-N
Molecular Weight 350.455 g/mol
SMILES O[C@]1(C[C@]([C@@]([C@@]2([C@]1([C@@](C(=O)O)(CCC2)[H])C)[H])(CCC1=CC(=O)OC1)C)(C)[H])[H]
SPLASH splash10-056r-5930000000-795a7c9661a7354ac994
Source of Spectrum J-57-865-4
Synonyms (1S,4aR,5S,6R,8S,8aS)-8-Hydroxy-5,6,8a-trimethyl-5-[2-(5-oxo-2,5-dihydro-furan-3-yl)-ethyl]-decahydro-naphthalene-1-carboxylic acid 8-Hydroxy-5,6,8a-trimethyl-5-[2-(5-oxo-2,5-dihydro-3-furanyl)ethyl]decahydro-1-naphthalenecarboxylic acid
Wiley ID 1342018