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2H-Pyrrol-2-one, 3-acetyl-1,5-dihydro-4-hydroxy-5-(phenylmethyl)-, (S)-
SpectraBase Compound ID 4XZjv9Ts1lh
InChI InChI=1S/C13H13NO3/c1-8(15)11-12(16)10(14-13(11)17)7-9-5-3-2-4-6-9/h2-6,10,16H,7H2,1H3,(H,14,17)/t10-/m0/s1
InChIKey KDCHPUAJMQKYQU-JTQLQIEISA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3R2QcxqGU1
Name 2H-Pyrrol-2-one, 3-acetyl-1,5-dihydro-4-hydroxy-5-(phenylmethyl)-, (S)-
Alternate Name(s) 3-Pyrrolin-2-one, 3-acetyl-5-benzyl-4-hydroxy-, L- (5S)-3-acetyl-5-benzyl-4-hydroxy-1,5-dihydro-2H-pyrrol-2-one 3-Acetyl-2-oxo-4-hydroxy-5-benzylpyrrolidine
CAS Registry Number 16820-45-4
Comments Less than 3 mono-isotopic peaks
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Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-8(15)11-12(16)10(14-13(11)17)7-9-5-3-2-4-6-9/h2-6,10,16H,7H2,1H3,(H,14,17)/t10-/m0/s1
InChIKey KDCHPUAJMQKYQU-JTQLQIEISA-N
Molecular Weight 231.251 g/mol
SMILES N1[C@](C(=C(C1=O)C(=O)C)O)(Cc1ccccc1)[H]
SPLASH splash10-001l-0590000000-a3bd825fbe986eb3f434
Source of Spectrum KC-1990-613-3
Wiley ID 1232779