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(5Z,7E)-(3S)-3-(tert-Butyldimethylsiloxy)-9,10-secocholesta-5,7,10(19)-trien-11.alpha.,25-diol
SpectraBase Compound ID CV5S6sqQmS3
InChI InChI=1S/C33H58O3Si/c1-23-13-16-28(36-37(9,10)31(3,4)5)21-25(23)14-15-26-20-27(34)22-33(8)29(17-18-30(26)33)24(2)12-11-19-32(6,7)35/h14-15,24,27-30,34-35H,1,11-13,16-22H2,2-10H3/b25-14-,26-15+/t24-,27+,28+,29-,30+,33-/m1/s1
InChIKey JPFHSKNMNNQPOU-AEJVPCTMSA-N
Mol Weight 530.9 g/mol
Molecular Formula C33H58O3Si
Exact Mass 530.415522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFFqXPxIguS
Name (5Z,7E)-(3S)-3-(tert-Butyldimethylsiloxy)-9,10-secocholesta-5,7,10(19)-trien-11.alpha.,25-diol
Alternate Name(s) (3S,5Z,7E,11alpha)-3-{[tert-butyl(dimethyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene-11,25-diol (5Z,7E)-(3S)-3-(tetra-Butyldimethylsiloxy)-9,10-secocholesta-5,7,10(19)-trien-11.alpha.,25-diol
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Formula C33H58O3Si
InChI InChI=1S/C33H58O3Si/c1-23-13-16-28(36-37(9,10)31(3,4)5)21-25(23)14-15-26-20-27(34)22-33(8)29(17-18-30(26)33)24(2)12-11-19-32(6,7)35/h14-15,24,27-30,34-35H,1,11-13,16-22H2,2-10H3/b25-14-,26-15+/t24-,27+,28+,29-,30+,33-/m1/s1
InChIKey JPFHSKNMNNQPOU-AEJVPCTMSA-N
Molecular Weight 530.909 g/mol
SMILES O[C@]1(C\C([C@]2([C@@]([C@@]([C@@](CCCC(O)(C)C)(C)[H])(CC2)[H])(C1)C)[H])=C\C=C/1C(CC[C@](O[Si](C(C)(C)C)(C)C)(C1)[H])=C)[H]
SPLASH splash10-0296-0910250000-8db7a14aad88e0f71c80
Source of Spectrum KC-1993-35-19
Wiley ID 778768