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

*Links on SpectraBase are not permalinks.

(3R,4R,9R,11aS)-4-hydroxy-3,6,10-trimethyl-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-9-yl acetate

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

(3R,4R,9R,11aS)-4-hydroxy-3,6,10-trimethyl-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-9-yl acetate
SpectraBase Compound ID JKKMNivFUSR
InChI InChI=1S/C17H24O5/c1-9-5-6-14(21-12(4)18)10(2)8-15-16(13(19)7-9)11(3)17(20)22-15/h5,8,11,13-16,19H,6-7H2,1-4H3/b9-5-,10-8-/t11-,13-,14-,15+,16?/m1/s1
InChIKey AQEYXIFALSSQPT-WLMWKXEHSA-N
Mol Weight 308.37 g/mol
Molecular Formula C17H24O5
Exact Mass 308.162374 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 B7QS5Ejyda8
Name (3R,4R,9R,11As)-4-hydroxy-3,6,10-trimethyl-2-oxo-2,3,3A,4,5,8,9,11A-octahydrocyclodeca[B]furan-9-yl acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.162373868 u
Formula C17H24O5
InChI InChI=1S/C17H24O5/c1-9-5-6-14(21-12(4)18)10(2)8-15-16(13(19)7-9)11(3)17(20)22-15/h5,8,11,13-16,19H,6-7H2,1-4H3/b9-5-,10-8-/t11-,13-,14-,15+,16?/m1/s1
InChIKey AQEYXIFALSSQPT-WLMWKXEHSA-N
SMILES [C@@]1(C\C=C/(C[C@](C2[C@](\C=C/1C)(OC([C@@]2(C)[H])=O)[H])(O)[H])C)(OC(C)=O)[H]