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

*Links on SpectraBase are not permalinks.

[(1S,7S,8S,8as)-8-[2-[(2R,4R)-4-Hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,4,4A,7,8,8A-octahydronaphthalen-1-yl] (2S)-2-methylbutanoate

View entire compound with spectra: 1 NMR

[(1S,7S,8S,8as)-8-[2-[(2R,4R)-4-Hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,4,4A,7,8,8A-octahydronaphthalen-1-yl] (2S)-2-methylbutanoate
SpectraBase Compound ID 8S8WkTTe6OB
InChI InChI=1S/C23H36O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h8-9,14-20,22,24H,4-7,10-13H2,1-3H3/t14-,15-,16?,17+,18+,19-,20-,22-/m0/s1
InChIKey VXDSGTRNDFHIJB-WWPRMLFWSA-N
Mol Weight 392.5 g/mol
Molecular Formula C23H36O5
Exact Mass 392.256274 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 9Uj5q32fKlT
Name [(1S,7S,8S,8as)-8-[2-[(2R,4R)-4-Hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,4,4A,7,8,8A-octahydronaphthalen-1-yl] (2S)-2-methylbutanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.256274254 u
Formula C23H36O5
InChI InChI=1S/C23H36O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h8-9,14-20,22,24H,4-7,10-13H2,1-3H3/t14-,15-,16?,17+,18+,19-,20-,22-/m0/s1
InChIKey VXDSGTRNDFHIJB-WWPRMLFWSA-N
Molecular Weight 392.536 g/mol
SMILES C1CCC2C=C[C@@]([C@@]([C@]2([C@]1(OC(=O)[C@](CC)(C)[H])[H])[H])(CC[C@]1(OC(C[C@@](C1)(O)[H])=O)[H])[H])(C)[H]