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(S)-3-(Dimethylphenylsilanyl)-8-hydroxy-3-methyl-1,2,3,4,6,12b-hexahydrobenzo[a]anthracene-7,12-dione
SpectraBase Compound ID D6tCdlPOydy
InChI InChI=1S/C27H28O3Si/c1-27(31(2,3)18-8-5-4-6-9-18)15-14-19-17(16-27)12-13-21-23(19)25(29)20-10-7-11-22(28)24(20)26(21)30/h4-12,19,28H,13-16H2,1-3H3/t19?,27-/m0/s1
InChIKey IXAIIMBGMUNLHM-NZVRHLSZSA-N
Mol Weight 428.6 g/mol
Molecular Formula C27H28O3Si
Exact Mass 428.180771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UXuMJMKMP5
Name (S)-3-(Dimethylphenylsilanyl)-8-hydroxy-3-methyl-1,2,3,4,6,12b-hexahydrobenzo[a]anthracene-7,12-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28O3Si
InChI InChI=1S/C27H28O3Si/c1-27(31(2,3)18-8-5-4-6-9-18)15-14-19-17(16-27)12-13-21-23(19)25(29)20-10-7-11-22(28)24(20)26(21)30/h4-12,19,28H,13-16H2,1-3H3/t19?,27-/m0/s1
InChIKey IXAIIMBGMUNLHM-NZVRHLSZSA-N
Molecular Weight 428.603 g/mol
SMILES Oc1c2c(C(C3=C(C2=O)CC=C2C3CC[C@@]([Si](c3ccccc3)(C)C)(C)C2)=O)ccc1
SPLASH splash10-002u-0940600000-ed002f190440cb7e0281
Source of Spectrum F-54-4835-21
Synonyms (3R*)-3-(Dimethylphenylsilanyl)-8-hydroxy-3-methyl-1,2,3,4,6,12b-hexahydrobenzo[a]anthracene-7,12-dione (3R*,12bS*)-3-(Dimethylphenylsilanyl)-8-hydroxy-3-methyl-1,2,3,4,6,12b-hexahydrobenzo[a]anthracene-7,12-dione (3S)-3-[dimethyl(phenyl)silyl]-8-hydroxy-3-methyl-1,2,3,4,6,12b-hexahydrobenzo[a]anthracene-7,12-dione
Wiley ID 806698