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3-[(TRIMETHYLSILYL)OXY]-ESTRA-1,3,5(10)-TRIENE-6,17-DIONE(6,17-DI-O-METHYLOXIME)
SpectraBase Compound ID FMA71ZGWTft
InChI InChI=1S/C23H34N2O3Si/c1-23-12-11-17-16-8-7-15(28-29(4,5)6)13-19(16)21(24-26-2)14-18(17)20(23)9-10-22(23)25-27-3/h7-8,13,17-18,20H,9-12,14H2,1-6H3/b24-21+,25-22+/t17-,18-,20+,23+/m1/s1
InChIKey WJNPTFCNXUIRIH-KZINKRHCSA-N
Mol Weight 414.6 g/mol
Molecular Formula C23H34N2O3Si
Exact Mass 414.233869 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21FcmwSZRzX
Name 3-[(TRIMETHYLSILYL)OXY]-ESTRA-1,3,5(10)-TRIENE-6,17-DIONE(6,17-DI-O-METHYLOXIME)
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Exact Mass 414.233869495 u
Formula C23H34N2O3Si
InChI InChI=1S/C23H34N2O3Si/c1-23-12-11-17-16-8-7-15(28-29(4,5)6)13-19(16)21(24-26-2)14-18(17)20(23)9-10-22(23)25-27-3/h7-8,13,17-18,20H,9-12,14H2,1-6H3/b24-21+,25-22+/t17-,18-,20+,23+/m1/s1
InChIKey WJNPTFCNXUIRIH-KZINKRHCSA-N
Molecular Weight 414.621 g/mol
Nominal Mass 414 u
Number of Peaks 256
SMILES c1(ccc2[C@]3(CC[C@@]4(\C(CC[C@]4([C@@]3(C\C(c2c1)=N/OC)[H])[H])=N\OC)C)[H])O[Si](C)(C)C
SPLASH splash10-03xr-3395600000-385bb10d2f52f04b16ff
Source File Reference LMCM-25226-177G
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 3-[(TRIMETHYLSILYL)OXY]ESTRA-1(10),2,4-TRIENE-6,17-DIONE BIS(O-METHYLOXIME) (1E,3aS,3bR,5E,9bS,11aS)-13-methyl-3-(trimethylsilyloxy)-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthrene-6,17(14H)-dione O,O-dimethyl dioxime
Wiley ID 4_1919