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(8R,9S,13S,14S)-13-methyl-3-trimethylsilyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
SpectraBase Compound ID GriP5qWbA8j
InChI InChI=1S/C21H30O2Si/c1-21-12-11-17-16-8-6-15(23-24(2,3)4)13-14(16)5-7-18(17)19(21)9-10-20(21)22/h6,8,13,17-19H,5,7,9-12H2,1-4H3/t17-,18-,19+,21+/m1/s1
InChIKey FRJOUBWXHQBBER-BNDYYXHWSA-N
Mol Weight 342.55 g/mol
Molecular Formula C21H30O2Si
Exact Mass 342.201507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9iaVbdRZwp
Name 3-[(TRIMETHYLSILYL)OXY]ESTRA-1(10),2,4-TRIEN-17-ONE
CAS Registry Number 1839-54-9
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 342.201506739 u
Formula C21H30O2Si
InChI InChI=1S/C21H30O2Si/c1-21-12-11-17-16-8-6-15(23-24(2,3)4)13-14(16)5-7-18(17)19(21)9-10-20(21)22/h6,8,13,17-19H,5,7,9-12H2,1-4H3/t17-,18-,19+,21+/m1/s1
InChIKey FRJOUBWXHQBBER-BNDYYXHWSA-N
Molecular Weight 342.554 g/mol
Nominal Mass 342 u
Number of Peaks 187
SMILES c1(ccc2[C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(CCc2c1)[H])[H])=O)C)[H])O[Si](C)(C)C
SPLASH splash10-05mo-2393000000-751e5f13040c4e8ba53d
Source File Reference LMCM-40206-908N
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ESTRA-1,3,5(10)-TRIENE-3-OL-17-ONE-3-TRIMETHYLSILYL ETHER (8R,9S,13S,14S)-13-methyl-3-(trimethylsilyloxy)-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthren-17(14H)-one
Wiley ID 4_2089