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5-[(1R,3aS,5R,6S,6aS)-5-(tert-Butyl-dimethyl-silanyloxy)-6-cyano-1-hydroxy-hexahydro-pentalen-(2E)-ylidene]-pentanoic acid methyl ester

View entire compound with spectra: 1 MS (GC)

5-[(1R,3aS,5R,6S,6aS)-5-(tert-Butyl-dimethyl-silanyloxy)-6-cyano-1-hydroxy-hexahydro-pentalen-(2E)-ylidene]-pentanoic acid methyl ester
SpectraBase Compound ID 29cMoJwb6EH
InChI InChI=1S/C21H35NO4Si/c1-21(2,3)27(5,6)26-17-12-15-11-14(9-7-8-10-18(23)25-4)20(24)19(15)16(17)13-22/h9,15-17,19-20,24H,7-8,10-12H2,1-6H3/b14-9+/t15-,16-,17+,19-,20-/m0/s1
InChIKey DVESSVVACANXBZ-MENLBKQUSA-N
Mol Weight 393.6 g/mol
Molecular Formula C21H35NO4Si
Exact Mass 393.233535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6OeNoNnEf3A
Name 5-[(1R,3aS,5R,6S,6aS)-5-(tert-Butyl-dimethyl-silanyloxy)-6-cyano-1-hydroxy-hexahydro-pentalen-(2E)-ylidene]-pentanoic acid methyl ester
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Formula C21H35NO4Si
InChI InChI=1S/C21H35NO4Si/c1-21(2,3)27(5,6)26-17-12-15-11-14(9-7-8-10-18(23)25-4)20(24)19(15)16(17)13-22/h9,15-17,19-20,24H,7-8,10-12H2,1-6H3/b14-9+/t15-,16-,17+,19-,20-/m0/s1
InChIKey DVESSVVACANXBZ-MENLBKQUSA-N
Molecular Weight 393.599 g/mol
SMILES O[C@]1(\C(=C\CCCC(=O)OC)C[C@@]2([C@]1([C@]([C@](O[Si](C(C)(C)C)(C)C)(C2)[H])(C#N)[H])[H])[H])[H]
SPLASH splash10-014r-0009000000-ca5b5c1481038dd48180
Source of Spectrum KC-0-2676-14
Synonyms (E)-(1SR,2RS,5SR,7RS,8SR)-3-(4'-Methoxycarbonylbutylidene)-7-tert-Butyldimethylsilyloxy-8-cyanobicyclo[3.3.0]octan-2-ol Methyl (5E)-5-((1R,3aS,5R,6S,6aS)-5-{[tert-butyl(dimethyl)silyl]oxy}-6-cyano-1-hydroxyhexahydro-2(1H)-pentalenylidene)pentanoate
Wiley ID 826099