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(+,-)-17b-t-butoxy-3-methoxy-7-(8->11a)abeo-estra-1,3,5(10)-triene
SpectraBase Compound ID 5JtOvYducQs
InChI InChI=1S/C23H34O2/c1-22(2,3)25-21-11-8-17-13-20-16(14-23(17,21)4)7-6-15-12-18(24-5)9-10-19(15)20/h9-10,12,16-17,20-21H,6-8,11,13-14H2,1-5H3/t16-,17?,20+,21-,23?/m0/s1
InChIKey NZSRIZCOPBGNQG-OHAISPICSA-N
Mol Weight 342.5 g/mol
Molecular Formula C23H34O2
Exact Mass 342.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GndgfZuvaFD
Name (+,-)-17b-t-butoxy-3-methoxy-7-(8->11a)abeo-estra-1,3,5(10)-triene
Alternate Name(s) (6aR,8S)-8-tert-butoxy-3-methoxy-7a-methyl-6,6a,7,7a,8,9,10,10a,11,11a-decahydro-5H-cyclopenta[b]phenanthrene
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Formula C23H34O2
InChI InChI=1S/C23H34O2/c1-22(2,3)25-21-11-8-17-13-20-16(14-23(17,21)4)7-6-15-12-18(24-5)9-10-19(15)20/h9-10,12,16-17,20-21H,6-8,11,13-14H2,1-5H3/t16-,17?,20+,21-,23?/m0/s1
InChIKey NZSRIZCOPBGNQG-OHAISPICSA-N
Molecular Weight 342.523 g/mol
SMILES C12(C[C@@]3(CCc4c([C@@]3(CC2CC[C@@]1(OC(C)(C)C)[H])[H])ccc(OC)c4)[H])C
SPLASH splash10-059i-4971000000-efdcc046f1ede586e2d3
Source of Spectrum B-45-71-0
Wiley ID 1337011