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(8S,13S,14S,17S)-17-tert-Butoxy-13-ethyl-3-methoxy-7,8,12,13,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene
SpectraBase Compound ID KNk3UocAnJM
InChI InChI=1S/C24H34O2/c1-6-24-14-13-19-18-10-8-17(25-5)15-16(18)7-9-20(19)21(24)11-12-22(24)26-23(2,3)4/h8,10,13,15,20-22H,6-7,9,11-12,14H2,1-5H3/t20-,21+,22+,24+/m1/s1
InChIKey KKGCUWYTNMQNPI-VCHRRKICSA-N
Mol Weight 354.5 g/mol
Molecular Formula C24H34O2
Exact Mass 354.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Fyf73TCJgg
Name (8S,13S,14S,17S)-17-tert-Butoxy-13-ethyl-3-methoxy-7,8,12,13,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthrene
Comments Less than 3 mono-isotopic peaks
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Formula C24H34O2
InChI InChI=1S/C24H34O2/c1-6-24-14-13-19-18-10-8-17(25-5)15-16(18)7-9-20(19)21(24)11-12-22(24)26-23(2,3)4/h8,10,13,15,20-22H,6-7,9,11-12,14H2,1-5H3/t20-,21+,22+,24+/m1/s1
InChIKey KKGCUWYTNMQNPI-VCHRRKICSA-N
Molecular Weight 354.534 g/mol
SMILES C1=2[C@]([C@@]3(CC[C@@]([C@]3(CC2)CC)(OC(C)(C)C)[H])[H])(CCc2c1ccc(OC)c2)[H]
SPLASH splash10-0udj-0049000000-964a7c97202f2b23df46
Source of Spectrum QE-14-1547-21
Synonyms 17.beta.-(t-Butoxy)-13.beta.-ethyl-3-methoxy-9.beta.-gona-1,3,5(10),11-tetraene (8S,13S,14S,17S)-13-ethyl-3-methoxy-17-[(2-methylpropan-2-yl)oxy]-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene
Wiley ID 1691908