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(4b.alpha.,8a.alpha.,9.beta.)-4b,5,6,7,8,8a,9,10-Octahydro-9-phenanthrenol acetate

View entire compound with spectra: 1 MS (GC)

(4b.alpha.,8a.alpha.,9.beta.)-4b,5,6,7,8,8a,9,10-Octahydro-9-phenanthrenol acetate
SpectraBase Compound ID 5WcHraADp7a
InChI InChI=1S/C16H20O2/c1-11(17)18-16-10-12-6-2-3-7-13(12)14-8-4-5-9-15(14)16/h2-3,6-7,14-16H,4-5,8-10H2,1H3/t14-,15-,16+/m1/s1
InChIKey VQFYQRZZTPPWPG-OAGGEKHMSA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bEblIxOY4i
Name (4b.alpha.,8a.alpha.,9.beta.)-4b,5,6,7,8,8a,9,10-Octahydro-9-phenanthrenol acetate
Alternate Name(s) (4bS,8aR,9S)-4b,5,6,7,8,8a,9,10-octahydro-9-phenanthrenyl acetate
CAS Registry Number 69401-84-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-11(17)18-16-10-12-6-2-3-7-13(12)14-8-4-5-9-15(14)16/h2-3,6-7,14-16H,4-5,8-10H2,1H3/t14-,15-,16+/m1/s1
InChIKey VQFYQRZZTPPWPG-OAGGEKHMSA-N
Molecular Weight 244.334 g/mol
SMILES [C@@]1([C@]2([C@@](CCCC2)([H])c2c(C1)cccc2)[H])(OC(=O)C)[H]
SPLASH splash10-0006-2900000000-b0e307e830a72b3889ea
Source of Spectrum J-44-1506-0
Wiley ID 1247445