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

*Links on SpectraBase are not permalinks.
[1R-[1.beta.(1R*,4R*),3a.alpha.,4.beta.,7a.beta.)]]-.beta.-fluorooctahydro-4-[(tetrahydro-2H-pyran-2-yl)oxy]-.alpha.,.alpha.,epsilon.,7a-tetramethyl-1H-indene-1-pentanol
SpectraBase Compound ID 8ugS3cvcjJS
InChI InChI=1S/C23H41FO3/c1-16(10-13-20(24)22(2,3)25)17-11-12-18-19(8-7-14-23(17,18)4)27-21-9-5-6-15-26-21/h16-21,25H,5-15H2,1-4H3/t16?,17-,18-,19+,20?,21?,23+/m0/s1
InChIKey NWHXRFPPQKTOPU-FXDOFKSOSA-N
Mol Weight 384.6 g/mol
Molecular Formula C23H41FO3
Exact Mass 384.303973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID FkiGKFcyDDb
Name [1R-[1.beta.(1R*,4R*),3a.alpha.,4.beta.,7a.beta.)]]-.beta.-fluorooctahydro-4-[(tetrahydro-2H-pyran-2-yl)oxy]-.alpha.,.alpha.,epsilon.,7a-tetramethyl-1H-indene-1-pentanol
CAS Registry Number 112139-01-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H41FO3
InChI InChI=1S/C23H41FO3/c1-16(10-13-20(24)22(2,3)25)17-11-12-18-19(8-7-14-23(17,18)4)27-21-9-5-6-15-26-21/h16-21,25H,5-15H2,1-4H3/t16?,17-,18-,19+,20?,21?,23+/m0/s1
InChIKey NWHXRFPPQKTOPU-FXDOFKSOSA-N
Molecular Weight 384.576 g/mol
SMILES OC(C(CCC([C@]1([C@@]2([C@]([C@@](OC3OCCCC3)([H])CCC2)(CC1)[H])C)[H])C)F)(C)C
SPLASH splash10-000i-9000000000-a833d21cc1948d58be82
Source of Spectrum J-53-1045-24
Synonyms 6-[(1S,3aR,4R,7aR)-7a-methyl-4-(tetrahydro-2H-pyran-2-yloxy)octahydro-1H-inden-1-yl]-3-fluoro-2-methyl-2-heptanol
Wiley ID 1361759