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(1R*,2R*,6R*,7S*)-2-(tert-Butyldimethylsiloxy)-7-[2-cyano-2-(1-ethoxyethoxy)ethyl]-6,7,9,9-tetramethylbicyclo[4.2.1]nonane
SpectraBase Compound ID KXxUazFU2A3
InChI InChI=1S/C26H49NO3Si/c1-12-28-19(2)29-20(18-27)16-25(8)17-21-22(30-31(10,11)23(3,4)5)14-13-15-26(25,9)24(21,6)7/h19-22H,12-17H2,1-11H3/t19?,20?,21-,22+,25+,26-/m0/s1
InChIKey KNPULJCZPPOUQL-YNRBGKMYSA-N
Mol Weight 451.8 g/mol
Molecular Formula C26H49NO3Si
Exact Mass 451.348171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ij1eq4tpVDC
Name (1R*,2R*,6R*,7S*)-2-(tert-Butyldimethylsiloxy)-7-[2-cyano-2-(1-ethoxyethoxy)ethyl]-6,7,9,9-tetramethylbicyclo[4.2.1]nonane
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Formula C26H49NO3Si
InChI InChI=1S/C26H49NO3Si/c1-12-28-19(2)29-20(18-27)16-25(8)17-21-22(30-31(10,11)23(3,4)5)14-13-15-26(25,9)24(21,6)7/h19-22H,12-17H2,1-11H3/t19?,20?,21-,22+,25+,26-/m0/s1
InChIKey KNPULJCZPPOUQL-YNRBGKMYSA-N
Molecular Weight 451.767 g/mol
SMILES [C@]1([C@@]2(C(C)(C)[C@@](C1)([C@](O[Si](C(C)(C)C)(C)C)(CCC2)[H])[H])C)(CC(C#N)OC(OCC)C)C
SPLASH splash10-006x-7009000000-cb680fc303b12108245c
Source of Spectrum J-60-3327-8
Synonyms 3-((1R,2R,6R,7S)-2-{[tert-butyl(dimethyl)silyl]oxy}-6,7,9,9-tetramethylbicyclo[4.2.1]non-7-yl)-2-(1-ethoxyethoxy)propanenitrile
Wiley ID 1387992