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Isocopalol .beta.-epoxide
SpectraBase Compound ID DhyIUQLGRvz
InChI InChI=1S/C20H34O2/c1-17(2)8-6-9-18(3)13(17)7-10-19(4)14(18)11-16-20(5,22-16)15(19)12-21/h13-16,21H,6-12H2,1-5H3/t13-,14+,15-,16?,18-,19+,20?/m0/s1
InChIKey WLMONTLKJONWRE-WFXHYPNQSA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qHqlSI5Cpr
Name Isocopalol .beta.-epoxide
Alternate Name(s) iso-copalol-.alpha.-epoxide [(4aS,6aR,7R,9aR,9bS)-4,4,6a,7a,9b-pentamethyltetradecahydrophenanthro[2,3-b]oxiren-7-yl]methanol
CAS Registry Number 72264-56-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-17(2)8-6-9-18(3)13(17)7-10-19(4)14(18)11-16-20(5,22-16)15(19)12-21/h13-16,21H,6-12H2,1-5H3/t13-,14+,15-,16?,18-,19+,20?/m0/s1
InChIKey WLMONTLKJONWRE-WFXHYPNQSA-N
Molecular Weight 306.490 g/mol
SMILES OC[C@]1([C@]2([C@]([C@]3(CCCC([C@@]3(CC2)[H])(C)C)C)([H])CC2C1(O2)C)C)[H]
SPLASH splash10-006y-2900000000-4fe752a806c6ad82442b
Source of Spectrum J-45-514-0
Wiley ID 1308559