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trans-4-Bromo-5-ethoxy-1-(p-methoxyphenyl)pyrrolidin-2-one
SpectraBase Compound ID Ag4t1LSliDW
InChI InChI=1S/C13H16BrNO3/c1-3-18-13-11(14)8-12(16)15(13)9-4-6-10(17-2)7-5-9/h4-7,11,13H,3,8H2,1-2H3/t11-,13+/m0/s1
InChIKey PBBFBTGTXQMICX-WCQYABFASA-N
Mol Weight 314.18 g/mol
Molecular Formula C13H16BrNO3
Exact Mass 313.031356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NQL7DJN5Qs
Name trans-4-Bromo-5-ethoxy-1-(p-methoxyphenyl)pyrrolidin-2-one
Alternate Name(s) (4S,5R)-4-bromo-5-ethoxy-1-(4-methoxyphenyl)-2-pyrrolidinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16BrNO3
InChI InChI=1S/C13H16BrNO3/c1-3-18-13-11(14)8-12(16)15(13)9-4-6-10(17-2)7-5-9/h4-7,11,13H,3,8H2,1-2H3/t11-,13+/m0/s1
InChIKey PBBFBTGTXQMICX-WCQYABFASA-N
Molecular Weight 314.179 g/mol
SMILES C1(N([C@@]([C@](C1)(Br)[H])(OCC)[H])c1ccc(cc1)OC)=O
SPLASH splash10-02ta-0469000000-50e53979e6fedfd8bfd6
Source of Spectrum F-51-12788-11
Wiley ID 794188