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5-[(1S,3aS,5R,6S,6aS)-1-Acetoxy-5-(tert-butyl-dimethyl-silanyloxy)-6-cyano-hexahydro-pentalen-(2Z)-ylidene]-pentanoic acid methyl ester
SpectraBase Compound ID G59VeZXGqFi
InChI InChI=1S/C23H37NO5Si/c1-15(25)28-22-16(10-8-9-11-20(26)27-5)12-17-13-19(18(14-24)21(17)22)29-30(6,7)23(2,3)4/h10,17-19,21-22H,8-9,11-13H2,1-7H3/b16-10-/t17-,18-,19+,21-,22+/m0/s1
InChIKey XWQSBILDZOQKSZ-JVJIKGFISA-N
Mol Weight 435.6 g/mol
Molecular Formula C23H37NO5Si
Exact Mass 435.2441 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AeOqiNtMvpb
Name 5-[(1S,3aS,5R,6S,6aS)-1-Acetoxy-5-(tert-butyl-dimethyl-silanyloxy)-6-cyano-hexahydro-pentalen-(2Z)-ylidene]-pentanoic acid methyl ester
Alternate Name(s) (E)-(1SR,2SR,5SR,7RS,8SR)-3-(4'-Methoxycarbonylbutylidene)-7-tert-Butyldimethylsilyloxy-8-cyanobicyclo[3.3.0]octan-2-yl acetate Methyl (5Z)-5-((1S,3aS,5R,6S,6aS)-1-(acetyloxy)-5-{[tert-butyl(dimethyl)silyl]oxy}-6-cyanohexahydro-2(1H)-pentalenylidene)pentanoate
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Formula C23H37NO5Si
InChI InChI=1S/C23H37NO5Si/c1-15(25)28-22-16(10-8-9-11-20(26)27-5)12-17-13-19(18(14-24)21(17)22)29-30(6,7)23(2,3)4/h10,17-19,21-22H,8-9,11-13H2,1-7H3/b16-10-/t17-,18-,19+,21-,22+/m0/s1
InChIKey XWQSBILDZOQKSZ-JVJIKGFISA-N
Molecular Weight 435.636 g/mol
SMILES [C@]1([C@@]2([C@]([C@](O[Si](C(C)(C)C)(C)C)(C[C@]2([H])C\C1=C/CCCC(=O)OC)[H])(C#N)[H])[H])(OC(=O)C)[H]
SPLASH splash10-016r-0904000000-f4cf42f1523d9d1e2f97
Source of Spectrum KC-0-2676-17
Wiley ID 826096