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2-Pyrrolidinecarboxylic acid, 1-[[2-[(tricyclo[3.3.1.1(3,7)]dec-1-ylcarbonyl)amino]phenyl]sulfonyl]-, methyl ester
SpectraBase Compound ID FpmUhjXyIVO
InChI InChI=1S/C23H30N2O5S/c1-30-21(26)19-6-4-8-25(19)31(28,29)20-7-3-2-5-18(20)24-22(27)23-12-15-9-16(13-23)11-17(10-15)14-23/h2-3,5,7,15-17,19H,4,6,8-14H2,1H3,(H,24,27)/t15-,16+,17-,19?,23-
InChIKey XTCUNAJFSAWWKK-OWCNVZJPSA-N
Mol Weight 446.56 g/mol
Molecular Formula C23H30N2O5S
Exact Mass 446.187543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bzbi8cNKgaL
Name 2-Pyrrolidinecarboxylic acid, 1-[[2-[(tricyclo[3.3.1.1(3,7)]dec-1-ylcarbonyl)amino]phenyl]sulfonyl]-, methyl ester
Alternate Name(s) Methyl 1-{[2-(adamantane-1-amido)benzene]sulfonyl}pyrrolidine-2-carboxylate 1-[2-[[1-adamantyl(oxo)methyl]amino]phenyl]sulfonyl-2-pyrrolidinecarboxylic acid methyl ester Methyl 1-[2-(adamantane-1-carbonylamino)phenyl]sulfonylpyrrolidine-2-carboxylate Methyl 1-[2-(1-adamantylcarbonylamino)phenyl]sulfonylpyrrolidine-2-carboxylate
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Formula C23H30N2O5S
InChI InChI=1S/C23H30N2O5S/c1-30-21(26)19-6-4-8-25(19)31(28,29)20-7-3-2-5-18(20)24-22(27)23-12-15-9-16(13-23)11-17(10-15)14-23/h2-3,5,7,15-17,19H,4,6,8-14H2,1H3,(H,24,27)/t15-,16+,17-,19?,23-
InChIKey XTCUNAJFSAWWKK-OWCNVZJPSA-N
Molecular Weight 446.562 g/mol
SMILES N(c1ccccc1S(N1C(C(=O)OC)CCC1)(=O)=O)C(C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=O
SPLASH splash10-0553-8942000000-8edd63ab5cad07cc408e
Source of Spectrum IY-2-5027-7
Wiley ID 1658260