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(3S)-1-[2-(3-methoxyphenyl)ethyl]-3-oxidanyl-pyrrolidine-2,5-dione
SpectraBase Compound ID 2ReoL2AxIXf
InChI InChI=1S/C13H15NO4/c1-18-10-4-2-3-9(7-10)5-6-14-12(16)8-11(15)13(14)17/h2-4,7,11,15H,5-6,8H2,1H3/t11-/m0/s1
InChIKey BEDFKCZCYURITM-NSHDSACASA-N
Mol Weight 249.27 g/mol
Molecular Formula C13H15NO4
Exact Mass 249.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAWPgFzlnx0
Name (3S)-1-[2-(3-methoxyphenyl)ethyl]-3-oxidanyl-pyrrolidine-2,5-dione
Alternate Name(s) (3S)-3-hydroxy-1-[2-(3-methoxyphenyl)ethyl]pyrrolidine-2,5-dione (3S)-3-hydroxy-1-[2-(3-methoxyphenyl)ethyl]pyrrolidine-2,5-quinone
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Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c1-18-10-4-2-3-9(7-10)5-6-14-12(16)8-11(15)13(14)17/h2-4,7,11,15H,5-6,8H2,1H3/t11-/m0/s1
InChIKey BEDFKCZCYURITM-NSHDSACASA-N
Molecular Weight 249.266 g/mol
SMILES O[C@@]1(C(N(C(C1)=O)CCc1cc(OC)ccc1)=O)[H]
SPLASH splash10-001i-0910000000-08b4db08d9fb6d43a483
Source of Spectrum SK-27-2805-4
Wiley ID 867931