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1,3,4,4a,7,8,8a,9-Octahydro-8a.beta.-[(1-ethoxyethoxy)methyl]-1.alpha.,4a.beta.-dimethyl-2,6-phenanthrenedione 2-(Ethylene Acetal)
SpectraBase Compound ID FaO6nfG9JLN
InChI InChI=1S/C23H34O5/c1-5-25-17(4)26-14-22-8-6-18(24)13-21(22)20-12-15(2)23(27-10-11-28-23)16(3)19(20)7-9-22/h7,13,15-17,20H,5-6,8-12,14H2,1-4H3/t15?,16-,17?,20-,22+/m0/s1
InChIKey CFZSXWHLFRWMSE-MVFXGHPOSA-N
Mol Weight 390.5 g/mol
Molecular Formula C23H34O5
Exact Mass 390.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTQUizRn5oi
Name 1,3,4,4a,7,8,8a,9-Octahydro-8a.beta.-[(1-ethoxyethoxy)methyl]-1.alpha.,4a.beta.-dimethyl-2,6-phenanthrenedione 2-(Ethylene Acetal)
Alternate Name(s) (1'S,4'aS,8'aS)-8'a-[(1-ethoxyethoxy)methyl]-1',3'-dimethyl-3',4',4'a,6',7',8',8'a,9'-octahydro-1'H-spiro[1,3-dioxolane-2,2'-phenanthrene]-6'-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O5
InChI InChI=1S/C23H34O5/c1-5-25-17(4)26-14-22-8-6-18(24)13-21(22)20-12-15(2)23(27-10-11-28-23)16(3)19(20)7-9-22/h7,13,15-17,20H,5-6,8-12,14H2,1-4H3/t15?,16-,17?,20-,22+/m0/s1
InChIKey CFZSXWHLFRWMSE-MVFXGHPOSA-N
Molecular Weight 390.520 g/mol
SMILES C1=2[C@@](C3=CC(=O)CC[C@@]3(CC2)COC(OCC)C)(CC(C2([C@]1(C)[H])OCCO2)C)[H]
SPLASH splash10-00dk-9000000000-155144b524c5f75df437
Source of Spectrum AJ-61-3598-40
Wiley ID 1364983