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(1R*,2R*,5S*,6S*,9S*)-2-(Methoxycarbonyl)-5,9-dimethyl-8-oxabicyclo[4.3.0]non-3-en-7-one
SpectraBase Compound ID II9S0Oo3NNr
InChI InChI=1S/C12H16O4/c1-6-4-5-8(11(13)15-3)10-7(2)16-12(14)9(6)10/h4-10H,1-3H3/t6-,7-,8+,9-,10+/m0/s1
InChIKey CSWFFTDUVABFME-GENCIFFESA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkAorscb5SV
Name (1R*,2R*,5S*,6S*,9S*)-2-(Methoxycarbonyl)-5,9-dimethyl-8-oxabicyclo[4.3.0]non-3-en-7-one
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Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-6-4-5-8(11(13)15-3)10-7(2)16-12(14)9(6)10/h4-10H,1-3H3/t6-,7-,8+,9-,10+/m0/s1
InChIKey CSWFFTDUVABFME-GENCIFFESA-N
Molecular Weight 224.256 g/mol
SMILES C1(O[C@@](C)([C@]2([C@@]1([C@](C=C[C@]2(C(=O)OC)[H])(C)[H])[H])[H])[H])=O
SPLASH splash10-0006-9700000000-acfdc9b4dc7418de67f9
Source of Spectrum J-56-4141-24
Synonyms Methyl (3S,3aR,4R,7S,7aS)-3,7-dimethyl-1-oxo-1,3,3a,4,7,7a-hexahydro-2-benzofuran-4-carboxylate
Wiley ID 1225027