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Benzyl 2-(isopropoxymethyl)-4-phenylpyrrolidine-1-carboxylate
SpectraBase Compound ID FuFGaYtecHA
InChI InChI=1S/C22H27NO3/c1-17(2)25-16-21-13-20(19-11-7-4-8-12-19)14-23(21)22(24)26-15-18-9-5-3-6-10-18/h3-12,17,20-21H,13-16H2,1-2H3
InChIKey JKCOLLUTHUFOCZ-UHFFFAOYSA-N
Mol Weight 353.46 g/mol
Molecular Formula C22H27NO3
Exact Mass 353.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LxN2jpAPQcZ
Name Benzyl 2-(isopropoxymethyl)-4-phenylpyrrolidine-1-carboxylate
Alternate Name(s) 4-Phenyl-2-(propan-2-yloxymethyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester Benzyl 4-phenyl-2-(propan-2-yloxymethyl)pyrrolidine-1-carboxylate Benzyl 2-(isopropoxymethyl)-4-phenyl-pyrrolidine-1-carboxylate (phenylmethyl) 4-phenyl-2-(propan-2-yloxymethyl)pyrrolidine-1-carboxylate
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Formula C22H27NO3
InChI InChI=1S/C22H27NO3/c1-17(2)25-16-21-13-20(19-11-7-4-8-12-19)14-23(21)22(24)26-15-18-9-5-3-6-10-18/h3-12,17,20-21H,13-16H2,1-2H3
InChIKey JKCOLLUTHUFOCZ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo101171g
Molecular Weight 353.462 g/mol
SMILES c1(ccccc1)COC(=O)N1CC(CC1COC(C)C)c1ccccc1
SPLASH splash10-0006-9060000000-5fe4a66f685efb637d00
Source of Spectrum J-75-6294/SM13-8e
Wiley ID 1751770