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(1'R,2'S,5'R,3aS*,8bS*)-Menthyl 2,3,3a,8b-tetrahydro-7-hydroxy-2-oxofuro[3,2-b]benzofuran-8-carboxylate
SpectraBase Compound ID Cepes4JjDcy
InChI InChI=1S/C21H26O6/c1-10(2)12-5-4-11(3)8-15(12)26-21(24)18-13(22)6-7-14-19(18)20-16(25-14)9-17(23)27-20/h6-7,10-12,15-16,20,22H,4-5,8-9H2,1-3H3/t11-,12+,15-,16+,20-/m1/s1
InChIKey VRYUXCRMQMUPHQ-PNTISFBMSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0McuTc480E
Name (1'R,2'S,5'R,3aS*,8bS*)-Menthyl 2,3,3a,8b-tetrahydro-7-hydroxy-2-oxofuro[3,2-b]benzofuran-8-carboxylate
Alternate Name(s) (1'R,2'S,5'R,3aR*,8bR*)-Menthyl 2,3,3a,8b-tetrahydro-7-hydroxy-2-oxofuro[3,2-b]benzofuran-8-carboxylate (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl (3aS,8bS)-7-hydroxy-2-oxo-2,3,3a,8b-tetrahydrofuro[3,2-b][1]benzofuran-8-carboxylate
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Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-10(2)12-5-4-11(3)8-15(12)26-21(24)18-13(22)6-7-14-19(18)20-16(25-14)9-17(23)27-20/h6-7,10-12,15-16,20,22H,4-5,8-9H2,1-3H3/t11-,12+,15-,16+,20-/m1/s1
InChIKey VRYUXCRMQMUPHQ-PNTISFBMSA-N
Molecular Weight 374.433 g/mol
SMILES Oc1c(c2[C@]3([C@@](CC(O3)=O)([H])Oc2cc1)[H])C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O
SPLASH splash10-00kr-0090000000-1cf035b8c82a6ed13fac
Source of Spectrum F-54-5373-15
Wiley ID 806843