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4-METHOXY-ESTRA-1,3,5(10)-TRIENE-3,16.ALPHA.,17.BETA.-TRIOL-TRI-TRIMETHYLSILYL ETHER
SpectraBase Compound ID J1FHgl8yekE
InChI InChI=1S/C28H50O4Si3/c1-28-17-16-20-19-14-15-24(30-33(3,4)5)26(29-2)22(19)13-12-21(20)23(28)18-25(31-34(6,7)8)27(28)32-35(9,10)11/h14-15,20-21,23,25,27H,12-13,16-18H2,1-11H3/t20-,21-,23+,25-,27+,28+/m1/s1
InChIKey WRQLFPQOMMGWNM-ZEYOCAOBSA-N
Mol Weight 535.0 g/mol
Molecular Formula C28H50O4Si3
Exact Mass 534.30169 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXxIr3RpAb4
Name 4-METHOXY-ESTRA-1,3,5(10)-TRIENE-3,16.ALPHA.,17.BETA.-TRIOL-TRI-TRIMETHYLSILYL ETHER
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 534.301689691 u
Formula C28H50O4Si3
InChI InChI=1S/C28H50O4Si3/c1-28-17-16-20-19-14-15-24(30-33(3,4)5)26(29-2)22(19)13-12-21(20)23(28)18-25(31-34(6,7)8)27(28)32-35(9,10)11/h14-15,20-21,23,25,27H,12-13,16-18H2,1-11H3/t20-,21-,23+,25-,27+,28+/m1/s1
InChIKey WRQLFPQOMMGWNM-ZEYOCAOBSA-N
Molecular Weight 534.959 g/mol
Nominal Mass 534 u
Number of Peaks 36
SMILES c1(ccc2[C@]3(CC[C@@]4([C@]([C@@](C[C@]4([C@@]3(CCc2c1OC)[H])[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])C)[H])O[Si](C)(C)C
SPLASH splash10-003r-1229150000-578e032d5fdc7d785009
Source File Reference LMCM-64748-461N
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 4-METHOXY-3,16,17-TRIS[(TRIMETHYLSILYL)OXY]ESTRA-1(10),2,4-TRIENE ((8R,9S,13S,14S,16R,17R)-4-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,16,17-triyl)tris(oxy)tris(trimethylsilane)
Wiley ID 4_1434