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(S)-ethyl 2-(1-(2,6-dibromophenyl)-2,5-dioxopyrrolidin-3-yl)buta-2,3-dienoate
SpectraBase Compound ID 4cW5zrwutSR
InChI InChI=1S/C16H13Br2NO4/c1-3-9(16(22)23-4-2)10-8-13(20)19(15(10)21)14-11(17)6-5-7-12(14)18/h5-7,10H,1,4,8H2,2H3/t10-/m0/s1
InChIKey OMPOTYGALGONMA-JTQLQIEISA-N
Mol Weight 443.09 g/mol
Molecular Formula C16H13Br2NO4
Exact Mass 440.921134 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbWLIeibRej
Name (S)-ethyl 2-(1-(2,6-dibromophenyl)-2,5-dioxopyrrolidin-3-yl)buta-2,3-dienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13Br2NO4
InChI InChI=1S/C16H13Br2NO4/c1-3-9(16(22)23-4-2)10-8-13(20)19(15(10)21)14-11(17)6-5-7-12(14)18/h5-7,10H,1,4,8H2,2H3/t10-/m0/s1
InChIKey OMPOTYGALGONMA-JTQLQIEISA-N
Literature Reference DOI 10.1002/adsc.201100434
Molecular Weight 443.091 g/mol
SMILES [C@@]1(CC(=O)N(c2c(cccc2Br)Br)C1=O)(C(C(=O)OCC)=C=C)[H]
SPLASH splash10-00kf-9300800000-239fb555934f5ce432e8
Source of Spectrum ASC-353-1973/SM97-3ww
Wiley ID 1762392