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1,4-Bis(2-tert-butyldimethylsiloxymethyl-1-azabicyclo[2.2.2]octan-5-yl)buta-1,3-diyne
SpectraBase Compound ID G2x918lU6MI
InChI InChI=1S/C32H56N2O2Si2/c1-27(2,3)31(21-35-37)29(7,8)25-15-17-33(31)19-23(25)13-11-12-14-24-20-34-18-16-26(24)30(9,10)32(34,22-36-38)28(4,5)6/h23-26H,15-22H2,1-10,37-38H3
InChIKey JWBPJCVYSUEBPB-UHFFFAOYSA-N
Mol Weight 557.0 g/mol
Molecular Formula C32H56N2O2Si2
Exact Mass 556.388032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nJ26KDCXTG
Name 1,4-Bis(2-tert-butyldimethylsiloxymethyl-1-azabicyclo[2.2.2]octan-5-yl)buta-1,3-diyne
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Formula C32H56N2O2Si2
InChI InChI=1S/C32H56N2O2Si2/c1-27(2,3)31(21-35-37)29(7,8)25-15-17-33(31)19-23(25)13-11-12-14-24-20-34-18-16-26(24)30(9,10)32(34,22-36-38)28(4,5)6/h23-26H,15-22H2,1-10,37-38H3
InChIKey JWBPJCVYSUEBPB-UHFFFAOYSA-N
Molecular Weight 556.982 g/mol
SMILES [SiH3]OCC1(C(C2C(C#CC#CC3CN4C(CO[SiH3])(C(C3CC4)(C)C)C(C)(C)C)CN1CC2)(C)C)C(C)(C)C
SPLASH splash10-00dj-3295600000-3b8a526e99497cbfb7f5
Source of Spectrum K-2001-61-31
Synonyms (1S,1'S,2R,2'R,4S,4'S,5S,5'S)-1,4-Bis(2-tert-butyldimethylsiloxymethyl-1-azabicyclo[2.2.2]octan-5-yl)buta-1,3-diyne 2-tert-Butyl-5-(4-{6-tert-butyl-5,5-dimethyl-6-[(silyloxy)methyl]-1-azabicyclo[2.2.2]oct-3-yl}-1,3-butadiynyl)-3,3-dimethyl-2-[(silyloxy)methyl]quinuclidine
Wiley ID 1578324