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1-(4-bromophenyl)-4-ethoxy-5-keto-3-pyrroline-2,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 72VvRguiODU
InChI InChI=1S/C16H16BrNO6/c1-4-24-13-11(15(20)22-2)12(16(21)23-3)18(14(13)19)10-7-5-9(17)6-8-10/h5-8,12H,4H2,1-3H3
InChIKey QZIOTSMBJLCALB-UHFFFAOYSA-N
Mol Weight 398.21 g/mol
Molecular Formula C16H16BrNO6
Exact Mass 397.0161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESEnGEK70DF
Name 1-(4-bromophenyl)-4-ethoxy-5-keto-3-pyrroline-2,3-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16BrNO6
InChI InChI=1S/C16H16BrNO6/c1-4-24-13-11(15(20)22-2)12(16(21)23-3)18(14(13)19)10-7-5-9(17)6-8-10/h5-8,12H,4H2,1-3H3
InChIKey QZIOTSMBJLCALB-UHFFFAOYSA-N
Molecular Weight 398.209 g/mol
SMILES C1(=C(C(=O)N(C1C(=O)OC)c1ccc(cc1)Br)OCC)C(=O)OC
SPLASH splash10-057v-1239000000-2ff9b40c69145c493b2e
Source of Spectrum SK-32-2532-2
Synonyms 1-(4-bromophenyl)-4-ethoxy-5-oxo-2H-pyrrole-2,3-dicarboxylic acid dimethyl ester Dimethyl 1-(4-bromophenyl)-4-ethoxy-5-oxidanylidene-2H-pyrrole-2,3-dicarboxylate Dimethyl 1-(4-bromophenyl)-4-ethoxy-5-oxo-2H-pyrrole-2,3-dicarboxylate
Wiley ID 882624