For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(3ar,4R,5as,6S,9ar,9bs)-4,6-Dihydroxy-5A,9-dimethyl-3-methylidene-4,5,6,7,9A,9B-hexahydro-3ah-benzo[G][1]benzofuran-2-one, 2ac derivative

View entire compound with spectra: 1 NMR

(3ar,4R,5as,6S,9ar,9bs)-4,6-Dihydroxy-5A,9-dimethyl-3-methylidene-4,5,6,7,9A,9B-hexahydro-3ah-benzo[G][1]benzofuran-2-one, 2ac derivative
SpectraBase Compound ID GKO3XyNlveJ
InChI InChI=1S/C19H24O6/c1-9-6-7-14(24-12(4)21)19(5)8-13(23-11(3)20)15-10(2)18(22)25-17(15)16(9)19/h6,13-17H,2,7-8H2,1,3-5H3/t13-,14+,15-,16+,17-,19-/m1/s1
InChIKey NKXKMROANZOOPX-PDDMAZILSA-N
Mol Weight 348.4 g/mol
Molecular Formula C19H24O6
Exact Mass 348.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EjZp950UrmF
Name (3ar,4R,5as,6S,9ar,9bs)-4,6-Dihydroxy-5A,9-dimethyl-3-methylidene-4,5,6,7,9A,9B-hexahydro-3ah-benzo[G][1]benzofuran-2-one, 2ac derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.157288487 u
Formula C19H24O6
InChI InChI=1S/C19H24O6/c1-9-6-7-14(24-12(4)21)19(5)8-13(23-11(3)20)15-10(2)18(22)25-17(15)16(9)19/h6,13-17H,2,7-8H2,1,3-5H3/t13-,14+,15-,16+,17-,19-/m1/s1
InChIKey NKXKMROANZOOPX-PDDMAZILSA-N
Molecular Weight 348.395 g/mol
SMILES [C@]12([H])OC(C([C@]2([H])[C@](OC(C)=O)(C[C@]2([C@@]1([H])C(C)=CC[C@@]2(OC(C)=O)[H])C)[H])=C)=O