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

*Links on SpectraBase are not permalinks.

(3R,3aS,9aR)-3-hydroxy-1,2,3,3a,5,6,7,8,9,9a-decahydrocyclopentacycloocten-4-one

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

(3R,3aS,9aR)-3-hydroxy-1,2,3,3a,5,6,7,8,9,9a-decahydrocyclopentacycloocten-4-one
SpectraBase Compound ID 3cZMIRcSFw0
InChI InChI=1S/C11H18O2/c12-9-5-3-1-2-4-8-6-7-10(13)11(8)9/h8,10-11,13H,1-7H2/t8-,10-,11-/m1/s1
InChIKey HLNUSQUUDUERAM-FBIMIBRVSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID 459ML8NpiPW
Name (3R,3as,9ar)-3-Hydroxy-1,2,3,3A,5,6,7,8,9,9A-decahydrocyclopentacycloocten-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c12-9-5-3-1-2-4-8-6-7-10(13)11(8)9/h8,10-11,13H,1-7H2/t8-,10-,11-/m1/s1
InChIKey HLNUSQUUDUERAM-FBIMIBRVSA-N
Molecular Weight 182.263 g/mol
SMILES [C@]12(C(=O)CCCCC[C@@]2(CC[C@]1(O)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959842