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(2R,5R)-2-butyl-5-(4-hydroxybutyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester
SpectraBase Compound ID EtRVQBS2XdZ
InChI InChI=1S/C20H31NO3/c1-2-3-11-18-13-14-19(12-7-8-15-22)21(18)20(23)24-16-17-9-5-4-6-10-17/h4-6,9-10,18-19,22H,2-3,7-8,11-16H2,1H3/t18-,19-/m1/s1
InChIKey MGEQLDWTJSDPML-RTBURBONSA-N
Mol Weight 333.47 g/mol
Molecular Formula C20H31NO3
Exact Mass 333.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IaDFy4pWO52
Name (2R,5R)-2-butyl-5-(4-hydroxybutyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester
Alternate Name(s) (2R,5R)-2-butyl-5-(4-hydroxybutyl)pyrrolidine-1-carboxylic acid benzyl ester (phenylmethyl) (2R,5R)-2-butyl-5-(4-oxidanylbutyl)pyrrolidine-1-carboxylate benzyl (2R,5R)-2-butyl-5-(4-hydroxybutyl)pyrrolidine-1-carboxylate
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Formula C20H31NO3
InChI InChI=1S/C20H31NO3/c1-2-3-11-18-13-14-19(12-7-8-15-22)21(18)20(23)24-16-17-9-5-4-6-10-17/h4-6,9-10,18-19,22H,2-3,7-8,11-16H2,1H3/t18-,19-/m1/s1
InChIKey MGEQLDWTJSDPML-RTBURBONSA-N
Molecular Weight 333.472 g/mol
SMILES OCCCC[C@]1(N(C(OCc2ccccc2)=O)[C@@](CC1)(CCCC)[H])[H]
SPLASH splash10-0006-9040000000-c1d898502e095179c018
Source of Spectrum J-57-5185-33
Wiley ID 1330376