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cis(+-)-Butyric Acid 2-Isobutyl-5-oxopyrrolidin-3-yl Ester
SpectraBase Compound ID ARxTyKqR4yu
InChI InChI=1S/C12H21NO3/c1-4-5-12(15)16-10-7-11(14)13-9(10)6-8(2)3/h8-10H,4-7H2,1-3H3,(H,13,14)/t9-,10-/m1/s1
InChIKey BEMJJJRHIBYCSF-NXEZZACHSA-N
Mol Weight 227.3 g/mol
Molecular Formula C12H21NO3
Exact Mass 227.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sryq39HIR8
Name cis(+-)-Butyric Acid 2-Isobutyl-5-oxopyrrolidin-3-yl Ester
Alternate Name(s) (2R,3R)-2-isobutyl-5-oxopyrrolidinyl butyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO3
InChI InChI=1S/C12H21NO3/c1-4-5-12(15)16-10-7-11(14)13-9(10)6-8(2)3/h8-10H,4-7H2,1-3H3,(H,13,14)/t9-,10-/m1/s1
InChIKey BEMJJJRHIBYCSF-NXEZZACHSA-N
Molecular Weight 227.304 g/mol
SMILES N1[C@@]([C@@](CC1=O)(OC(=O)CCC)[H])(CC(C)C)[H]
SPLASH splash10-059g-9500000000-5a266a8d858302f119e8
Source of Spectrum J-58-4012-10
Wiley ID 1228589