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17.beta.-(t-Butoxy)-3,3-dimethyl-9.beta.-estra-1(10),4,11-triene
SpectraBase Compound ID HFfQRgQQF5B
InChI InChI=1S/C24H36O/c1-22(2,3)25-21-10-9-20-19-8-7-16-15-23(4,5)13-11-17(16)18(19)12-14-24(20,21)6/h11-12,14-15,18-21H,7-10,13H2,1-6H3/t18-,19+,20-,21-,24-/m0/s1
InChIKey ZTUOWPDWZVTFJS-KEVRVKNQSA-N
Mol Weight 340.6 g/mol
Molecular Formula C24H36O
Exact Mass 340.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hs2JVRRcY0O
Name 17.beta.-(t-Butoxy)-3,3-dimethyl-9.beta.-estra-1(10),4,11-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O
InChI InChI=1S/C24H36O/c1-22(2,3)25-21-10-9-20-19-8-7-16-15-23(4,5)13-11-17(16)18(19)12-14-24(20,21)6/h11-12,14-15,18-21H,7-10,13H2,1-6H3/t18-,19+,20-,21-,24-/m0/s1
InChIKey ZTUOWPDWZVTFJS-KEVRVKNQSA-N
Molecular Weight 340.551 g/mol
SMILES C=12[C@]3([C@@]([C@@]4(CC[C@@]([C@]4(C=C3)C)(OC(C)(C)C)[H])[H])([H])CCC2=CC(CC1)(C)C)[H]
SPLASH splash10-05o0-4190000000-79f47af02ed8f814b743
Source of Spectrum K1-2001-1622-15
Synonyms (9beta,17beta)-17-tert-butoxy-3,3-dimethylestra-1(10),4,11-triene (8S,9R,13S,14S,17S)-3,3,13-trimethyl-17-[(2-methylpropan-2-yl)oxy]-6,7,8,9,14,15,16,17-octahydro-2H-cyclopenta[a]phenanthrene
Wiley ID 846459