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(2S)-1-acetyl-5-keto-proline
SpectraBase Compound ID FQpqJAdH7y1
InChI InChI=1S/C7H9NO4/c1-4(9)8-5(7(11)12)2-3-6(8)10/h5H,2-3H2,1H3,(H,11,12)/t5-/m0/s1
InChIKey AYNBBSMJRSAAHP-YFKPBYRVSA-N
Mol Weight 171.15 g/mol
Molecular Formula C7H9NO4
Exact Mass 171.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mifW0tKjV6
Name (2S)-1-acetyl-5-keto-proline
Alternate Name(s) (2S)-1-acetyl-5-oxo-2-pyrrolidinecarboxylic acid (2S)-1-acetyl-5-oxo-pyrrolidine-2-carboxylic acid (2S)-1-ethanoyl-5-oxidanylidene-pyrrolidine-2-carboxylic acid L-1-acetyl-5-oxoproline EINECS 260-392-6
CAS Registry Number 56805-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9NO4
InChI InChI=1S/C7H9NO4/c1-4(9)8-5(7(11)12)2-3-6(8)10/h5H,2-3H2,1H3,(H,11,12)/t5-/m0/s1
InChIKey AYNBBSMJRSAAHP-YFKPBYRVSA-N
Molecular Weight 171.152 g/mol
SMILES OC([C@]1(N(C(CC1)=O)C(=O)C)[H])=O
SPLASH splash10-001i-1900000000-bc9a962bbde61460a48a
Source of Spectrum EP-7031-0-0
Wiley ID 1167805