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Ethyl (4S)-1-benzyl-4-isobutyl-2-oxo-pyrrolidine-3-carboxylate
SpectraBase Compound ID Bq8LCnqVbWd
InChI InChI=1S/C18H25NO3/c1-4-22-18(21)16-15(10-13(2)3)12-19(17(16)20)11-14-8-6-5-7-9-14/h5-9,13,15-16H,4,10-12H2,1-3H3/t15-,16?/m1/s1
InChIKey ISMIDMVCHVXIIH-AAFJCEBUSA-N
Mol Weight 303.4 g/mol
Molecular Formula C18H25NO3
Exact Mass 303.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUPKEXgiYwZ
Name Ethyl (4S)-1-benzyl-4-isobutyl-2-oxo-pyrrolidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO3
InChI InChI=1S/C18H25NO3/c1-4-22-18(21)16-15(10-13(2)3)12-19(17(16)20)11-14-8-6-5-7-9-14/h5-9,13,15-16H,4,10-12H2,1-3H3/t15-,16?/m1/s1
InChIKey ISMIDMVCHVXIIH-AAFJCEBUSA-N
Instrument Name Hewlett-Packard 5971
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901086
Molecular Weight 303.402 g/mol
SMILES C1(N(C[C@](C1C(OCC)=O)(CC(C)C)[H])Cc1ccccc1)=O
SPLASH splash10-0006-9261000000-a8741911cde8ba3dcdb9
Sample Comments Major diastereoisomer
Source of Spectrum U1-2020-SM7-12
Wiley ID 1858809