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(3R,4R,5S)-3-ethyl-5-phenyl-4-formyl-pyrrolidine-2,2-diethyl-dicarboxylate
SpectraBase Compound ID C7uBlhkZ0lF
InChI InChI=1S/C19H25NO5/c1-4-15-14(12-21)16(13-10-8-7-9-11-13)20-19(15,17(22)24-5-2)18(23)25-6-3/h7-12,14-16,20H,4-6H2,1-3H3/t14-,15-,16-/m1/s1
InChIKey NVPUBGGTPMCKJT-BZUAXINKSA-N
Mol Weight 347.41 g/mol
Molecular Formula C19H25NO5
Exact Mass 347.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eeGdq2jzzj
Name (3R,4R,5S)-3-ethyl-5-phenyl-4-formyl-pyrrolidine-2,2-diethyl-dicarboxylate
Appearance Colorless liquid
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Formula C19H25NO5
InChI InChI=1S/C19H25NO5/c1-4-15-14(12-21)16(13-10-8-7-9-11-13)20-19(15,17(22)24-5-2)18(23)25-6-3/h7-12,14-16,20H,4-6H2,1-3H3/t14-,15-,16-/m1/s1
InChIKey NVPUBGGTPMCKJT-BZUAXINKSA-N
Instrument Name Hewlett Packard 5989B??
Ionization Type EI
Molecular Weight 347.411 g/mol
Reported Formula C19H25NO5
SMILES N1C([C@@]([C@]([C@]1(c1ccccc1)[H])(C=O)[H])(CC)[H])(C(OCC)=O)C(=O)OCC
SPLASH splash10-00di-0190000000-2ee238befe605a79cebf
Sample Comments mixture of endo/exo isomers (>95:<5), 97% ee, 97% ee
Source of Spectrum ES2322739B1
Wiley ID 1841914