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(cis/trans)-Isopropyl (1'-benzyl-4'-methyl-3'-oxopyrrolidin-2'-yl)-acetate
SpectraBase Compound ID 5FfbHtkhMT1
InChI InChI=1S/C17H23NO3/c1-12(2)21-16(19)9-15-17(20)13(3)10-18(15)11-14-7-5-4-6-8-14/h4-8,12-13,15H,9-11H2,1-3H3/t13?,15-/m0/s1
InChIKey CGRADFBPTQGSIE-WUJWULDRSA-N
Mol Weight 289.38 g/mol
Molecular Formula C17H23NO3
Exact Mass 289.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D60WtTzmkjA
Name (cis/trans)-Isopropyl (1'-benzyl-4'-methyl-3'-oxopyrrolidin-2'-yl)-acetate
Alternate Name(s) Isopropyl (1'-benzyl-3'-methyl-4'-oxopyrrolidin-2'-yl)-acetate isopropyl[(2S)-1-benzyl-4-methyl-3-oxopyrrolidinyl]acetate
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Formula C17H23NO3
InChI InChI=1S/C17H23NO3/c1-12(2)21-16(19)9-15-17(20)13(3)10-18(15)11-14-7-5-4-6-8-14/h4-8,12-13,15H,9-11H2,1-3H3/t13?,15-/m0/s1
InChIKey CGRADFBPTQGSIE-WUJWULDRSA-N
Molecular Weight 289.375 g/mol
SMILES [C@@]1(N(CC(C1=O)C)Cc1ccccc1)(CC(=O)OC(C)C)[H]
SPLASH splash10-0006-9110000000-b0a4498fd1ad0f6d7d88
Source of Spectrum D1-2006-2742-14
Wiley ID 1614276