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(S)-ethyl 2-(1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl)buta-2,3-dienoate
SpectraBase Compound ID DhVTlaYK52f
InChI InChI=1S/C16H14ClNO4/c1-3-12(16(21)22-4-2)13-9-14(19)18(15(13)20)11-7-5-10(17)6-8-11/h5-8,13H,1,4,9H2,2H3/t13-/m0/s1
InChIKey STAUIBAJZZEOIL-ZDUSSCGKSA-N
Mol Weight 319.74 g/mol
Molecular Formula C16H14ClNO4
Exact Mass 319.061136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GsBCFx69xbT
Name (S)-ethyl 2-(1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl)buta-2,3-dienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14ClNO4
InChI InChI=1S/C16H14ClNO4/c1-3-12(16(21)22-4-2)13-9-14(19)18(15(13)20)11-7-5-10(17)6-8-11/h5-8,13H,1,4,9H2,2H3/t13-/m0/s1
InChIKey STAUIBAJZZEOIL-ZDUSSCGKSA-N
Literature Reference DOI 10.1002/adsc.201100434
Molecular Weight 319.744 g/mol
SMILES [C@@]1(CC(=O)N(c2ccc(cc2)Cl)C1=O)(C(=C=C)C(=O)OCC)[H]
SPLASH splash10-016u-9343000000-ff2bc766757f3d9623f0
Source of Spectrum ASC-353-1973/SM93-3vv
Wiley ID 1762391