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17-O-isopentyloxime of 7.alpha.-hydroxy-4-androstene-3,17-dione TMS ether
SpectraBase Compound ID IaOKGvpS0NL
InChI InChI=1S/C27H45NO3Si/c1-18(2)12-15-30-28-24-9-8-21-25-22(11-14-27(21,24)4)26(3)13-10-20(29)16-19(26)17-23(25)31-32(5,6)7/h16,18,21-23,25H,8-15,17H2,1-7H3/b28-24+/t21-,22-,23+,25-,26-,27-/m0/s1
InChIKey OSSOVUPOCVELLG-SDASNNJLSA-N
Mol Weight 459.7 g/mol
Molecular Formula C27H45NO3Si
Exact Mass 459.316871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B7ZqtTP6sVo
Name 17-O-isopentyloxime of 7.alpha.-hydroxy-4-androstene-3,17-dione TMS ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H45NO3Si
InChI InChI=1S/C27H45NO3Si/c1-18(2)12-15-30-28-24-9-8-21-25-22(11-14-27(21,24)4)26(3)13-10-20(29)16-19(26)17-23(25)31-32(5,6)7/h16,18,21-23,25H,8-15,17H2,1-7H3/b28-24+/t21-,22-,23+,25-,26-,27-/m0/s1
InChIKey OSSOVUPOCVELLG-SDASNNJLSA-N
Molecular Weight 459.746 g/mol
SMILES [C@@]12(C(=CC(CC2)=O)C[C@]([C@]2([C@@]3(CC\C([C@]3(CC[C@]12[H])C)=N/OCCC(C)C)[H])[H])(O[Si](C)(C)C)[H])C
SPLASH splash10-053r-0971400000-5e39bb2fdb5ab5a3ebf5
Source of Spectrum KO-3-85-2
Synonyms (7alpha)-7-[(trimethylsilyl)oxy]androst-4-ene-3,17-dione 17-(O-isopentyloxime)
Wiley ID 1390260