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(1R*,2S*,3R*,5S*,9R*(1E,3E,5E),10S*)-(+-)-9-(5-Methyl-1,3,5-heptatrienyl)-2-oxo-4-oxa-8-azatricyclo[8.1.0.0(3,5)]undecane-8-carboxylic acid 2-(trimethylsilyl)ethyl ester
SpectraBase Compound ID DIIXAuCKu79
InChI InChI=1S/C23H35NO4Si/c1-6-16(2)9-7-8-10-19-17-15-18(17)21(25)22-20(28-22)11-12-24(19)23(26)27-13-14-29(3,4)5/h6-10,17-20,22H,11-15H2,1-5H3/b9-7+,10-8+,16-6+/t17-,18+,19+,20-,22+/m0/s1
InChIKey XLKRNFIAILTCLQ-GVWORVOISA-N
Mol Weight 417.6 g/mol
Molecular Formula C23H35NO4Si
Exact Mass 417.233535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Em2znnivPPh
Name (1R*,2S*,3R*,5S*,9R*(1E,3E,5E),10S*)-(+-)-9-(5-Methyl-1,3,5-heptatrienyl)-2-oxo-4-oxa-8-azatricyclo[8.1.0.0(3,5)]undecane-8-carboxylic acid 2-(trimethylsilyl)ethyl ester
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Formula C23H35NO4Si
InChI InChI=1S/C23H35NO4Si/c1-6-16(2)9-7-8-10-19-17-15-18(17)21(25)22-20(28-22)11-12-24(19)23(26)27-13-14-29(3,4)5/h6-10,17-20,22H,11-15H2,1-5H3/b9-7+,10-8+,16-6+/t17-,18+,19+,20-,22+/m0/s1
InChIKey XLKRNFIAILTCLQ-GVWORVOISA-N
Molecular Weight 417.621 g/mol
SMILES [C@@]12([C@]([C@](N(C(=O)OCC[Si](C)(C)C)CC[C@]3([C@](C2=O)(O3)[H])[H])(\C=C\C=C\C(=C\C)C)[H])([H])C1)[H]
SPLASH splash10-00di-0093000000-e89b4baa95991fbaf100
Source of Spectrum C-115-39-57
Synonyms 2-(trimethylsilyl)ethyl (1R,3R,5S,9R,10S)-9-[(1E,3E,5E)-5-methyl-1,3,5-heptatrienyl]-2-oxo-4-oxa-8-azatricyclo[8.1.0.0(3,5)]undecane-8-carboxylate
Wiley ID 1376848