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(2S,3S)-2-Butyl-5-oxo-2-phenylpyrrolidine-3-carboxylic acid
SpectraBase Compound ID 6dTrzDH2RQe
InChI InChI=1S/C15H19NO3/c1-2-3-9-15(11-7-5-4-6-8-11)12(14(18)19)10-13(17)16-15/h4-8,12H,2-3,9-10H2,1H3,(H,16,17)(H,18,19)/t12-,15-/m1/s1
InChIKey JVVSESYIPWVYSO-IUODEOHRSA-N
Mol Weight 261.32 g/mol
Molecular Formula C15H19NO3
Exact Mass 261.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbqQUnFC1Db
Name (2S,3S)-2-Butyl-5-oxo-2-phenylpyrrolidine-3-carboxylic acid
Appearance Yellow powder
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Exact Mass 261.136493473 u
Formula C15H19NO3
InChI InChI=1S/C15H19NO3/c1-2-3-9-15(11-7-5-4-6-8-11)12(14(18)19)10-13(17)16-15/h4-8,12H,2-3,9-10H2,1H3,(H,16,17)(H,18,19)/t12-,15-/m1/s1
InChIKey JVVSESYIPWVYSO-IUODEOHRSA-N
Instrument Name Thermo Finnigan Polaris Q
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900685
Molecular Weight 261.321 g/mol
Quality 26
Reported Formula C15H19NO3
SMILES N1C(C[C@](C(=O)O)([C@@]1(CCCC)C1=CC=CC=C1)[H])=O
SPLASH splash10-0ue9-0790000000-5a5dda37306182e0c2a3
Sample Comments dr = 93:7
Source of Spectrum K1-2019-4715-(2S,3S)-1m (DOI: 10.1002/ejoc.201900685)
Wiley ID 1891967