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(1S,5R)-8-Tosyl-2-((trimethylsilyl)ethynyl)-8-azabicyclo[3.2.1]octan-2-ol
SpectraBase Compound ID 9bVlb1LJ3Fs
InChI InChI=1S/C19H27NO3SSi/c1-15-5-8-17(9-6-15)24(22,23)20-16-7-10-18(20)19(21,12-11-16)13-14-25(2,3)4/h5-6,8-9,16,18,21H,7,10-12H2,1-4H3
InChIKey BVGZECNQYBVFEN-UHFFFAOYSA-N
Mol Weight 377.57 g/mol
Molecular Formula C19H27NO3SSi
Exact Mass 377.148091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESwq3yTrNhn
Name (1S,5R)-8-Tosyl-2-((trimethylsilyl)ethynyl)-8-azabicyclo[3.2.1]octan-2-ol
Appearance White solid
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Formula C19H27NO3SSi
InChI InChI=1S/C19H27NO3SSi/c1-15-5-8-17(9-6-15)24(22,23)20-16-7-10-18(20)19(21,12-11-16)13-14-25(2,3)4/h5-6,8-9,16,18,21H,7,10-12H2,1-4H3
InChIKey BVGZECNQYBVFEN-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.202000650
Molecular Weight 377.574 g/mol
Reported Formula C19H27NO3SSi
SMILES OC1(CCC2N(C1CC2)S(=O)(=O)c1ccc(cc1)C)C#C[Si](C)(C)C
SPLASH splash10-00di-4090000000-ef9699a3b7de2ef16d39
Sample Comments diastereomeric mixture, dr = 1.2:1, dr = 1.2:1
Source of Spectrum ACI-59-SM47-5
Thin-Layer Chromatography Rf = 0.43 and 0.5 (petroleum ether/EtOAc, 7:3)
Wiley ID 1857759