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3-Pyrrolidinecarboxylic acid, 5-[[(1,1-dimethylethyl)amino]carbonyl]-4-methyl-2-phenyl-, methyl ester, (2.alpha.,3.alpha.,4.beta.,5.alpha.)-(.+-.)-
SpectraBase Compound ID A1OBx4GvzTz
InChI InChI=1S/C18H26N2O3/c1-11-13(17(22)23-5)15(12-9-7-6-8-10-12)19-14(11)16(21)20-18(2,3)4/h6-11,13-15,19H,1-5H3,(H,20,21)
InChIKey NEVQCCRERYXYRI-UHFFFAOYSA-N
Mol Weight 318.42 g/mol
Molecular Formula C18H26N2O3
Exact Mass 318.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HROHLSmkkK7
Name 3-Pyrrolidinecarboxylic acid, 5-[[(1,1-dimethylethyl)amino]carbonyl]-4-methyl-2-phenyl-, methyl ester, (2.alpha.,3.alpha.,4.beta.,5.alpha.)-(.+-.)-
CAS Registry Number 113273-86-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26N2O3
InChI InChI=1S/C18H26N2O3/c1-11-13(17(22)23-5)15(12-9-7-6-8-10-12)19-14(11)16(21)20-18(2,3)4/h6-11,13-15,19H,1-5H3,(H,20,21)
InChIKey NEVQCCRERYXYRI-UHFFFAOYSA-N
Molecular Weight 318.417 g/mol
SMILES N1C(C(NC(C)(C)C)=O)C(C(C1c1ccccc1)C(=O)OC)C
SPLASH splash10-014i-0090000000-1ffb58e11257ea71c529
Source of Spectrum J-53-1390-6
Synonyms 2-(t-butylcarbamoyl)-3-methyl-4-methoxycarbonyl-5-phenyl-2,3,4,5-tetrahydropyrrole Methyl 5-[(tert-butylamino)carbonyl]-4-methyl-2-phenyl-3-pyrrolidinecarboxylate
Wiley ID 1318554