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(5E,7E,10E)-3-(tert-Butyldimethylsilyloxy)-19-fluoro-9,10-seco-5,7,10(19)-cholestriene
SpectraBase Compound ID 86ApSJmQMHa
InChI InChI=1S/C33H57FOSi/c1-24(2)12-10-13-25(3)30-19-20-31-26(14-11-21-33(30,31)7)15-16-27-22-29(18-17-28(27)23-34)35-36(8,9)32(4,5)6/h15-16,23-25,29-31H,10-14,17-22H2,1-9H3/b26-15+,27-16+,28-23+/t25-,29+,30?,31?,33-/m1/s1
InChIKey LSJIAKZMKQRPAP-VEZSEBLXSA-N
Mol Weight 516.9 g/mol
Molecular Formula C33H57FOSi
Exact Mass 516.416271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ixCDHpHtzq
Name (5E,7E,10E)-3-(tert-Butyldimethylsilyloxy)-19-fluoro-9,10-seco-5,7,10(19)-cholestriene
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Formula C33H57FOSi
InChI InChI=1S/C33H57FOSi/c1-24(2)12-10-13-25(3)30-19-20-31-26(14-11-21-33(30,31)7)15-16-27-22-29(18-17-28(27)23-34)35-36(8,9)32(4,5)6/h15-16,23-25,29-31H,10-14,17-22H2,1-9H3/b26-15+,27-16+,28-23+/t25-,29+,30?,31?,33-/m1/s1
InChIKey LSJIAKZMKQRPAP-VEZSEBLXSA-N
Molecular Weight 516.901 g/mol
SMILES [C@]12(C(\C(=C\C=C\3\C(=C\F)CC[C@](O[Si](C(C)(C)C)(C)C)(C3)[H])CCC1)CCC2[C@@](CCCC(C)C)(C)[H])C
SPLASH splash10-014i-0981180000-d2b8533463cbc0db014e
Source of Spectrum E2-48-1491-13
Wiley ID 1555353