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1-(2-Hydroxy-3-(4-methylphenylamino)-propyl)-5-oxo-pyrrolidine-2-carboxylic acid ethyl ester
SpectraBase Compound ID GbBHBxt2Iv8
InChI InChI=1S/C17H24N2O4/c1-3-23-17(22)15-8-9-16(21)19(15)11-14(20)10-18-13-6-4-12(2)5-7-13/h4-7,14-15,18,20H,3,8-11H2,1-2H3
InChIKey DWSZCBQPVFMCBW-UHFFFAOYSA-N
Mol Weight 320.39 g/mol
Molecular Formula C17H24N2O4
Exact Mass 320.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPGX33rFcQG
Name 1-(2-Hydroxy-3-(4-methylphenylamino)-propyl)-5-oxo-pyrrolidine-2-carboxylic acid ethyl ester
Appearance Yellow sticky oil
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Exact Mass 320.173607257 u
Formula C17H24N2O4
InChI InChI=1S/C17H24N2O4/c1-3-23-17(22)15-8-9-16(21)19(15)11-14(20)10-18-13-6-4-12(2)5-7-13/h4-7,14-15,18,20H,3,8-11H2,1-2H3
InChIKey DWSZCBQPVFMCBW-UHFFFAOYSA-N
Instrument Name MAT 700 ITD, Varian MAT 311
Ionization Type EI
Literature Reference DOI 10.1186/1860-5397-3-28
Molecular Weight 320.389 g/mol
Quality 350
Reported Formula C17H24N2O4
SMILES N(CC(CN1C(CCC1C(=O)OCC)=O)O)C1=CC=C(C=C1)C
SPLASH splash10-00di-2901000000-458aa3fc55602266488f
Sample Comments Mixture of diastereoisomers = (53:47)
Source of Spectrum BJO-3-SM3-7b (DOI: 10.1186/1860-5397-3-28)
Thin-Layer Chromatography 0.86 (toluidine)
Wiley ID 1908963