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N-(Methoxycarbonyl)-3-(p-tolylsulfonyl)-2-(trimethylsilyl)-7-azabicyclo[2.2.1]heptane
SpectraBase Compound ID D7BTV1F1Ygc
InChI InChI=1S/C18H27NO4SSi/c1-12-6-8-13(9-7-12)24(21,22)16-14-10-11-15(17(16)25(3,4)5)19(14)18(20)23-2/h6-9,14-17H,10-11H2,1-5H3/t14-,15+,16?,17?/m0/s1
InChIKey AVFVIKHZUPDRCJ-NJINODPHSA-N
Mol Weight 381.56 g/mol
Molecular Formula C18H27NO4SSi
Exact Mass 381.143006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Av1GwNMLIBt
Name N-(Methoxycarbonyl)-3-(p-tolylsulfonyl)-2-(trimethylsilyl)-7-azabicyclo[2.2.1]heptane
Alternate Name(s) methyl 2-[(4-methylphenyl)sulfonyl]-3-(trimethylsilyl)-7-azabicyclo[2.2.1]heptane-7-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C18H27NO4SSi
InChI InChI=1S/C18H27NO4SSi/c1-12-6-8-13(9-7-12)24(21,22)16-14-10-11-15(17(16)25(3,4)5)19(14)18(20)23-2/h6-9,14-17H,10-11H2,1-5H3/t14-,15+,16?,17?/m0/s1
InChIKey AVFVIKHZUPDRCJ-NJINODPHSA-N
Molecular Weight 381.562 g/mol
SMILES [C@]12(C(C([C@](CC2)(N1C(=O)OC)[H])S(=O)(=O)c1ccc(cc1)C)[Si](C)(C)C)[H]
SPLASH splash10-004i-0093000000-786b3436f9ead917faa6
Source of Spectrum U1-1998-2000-12
Wiley ID 751748