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(E)-2-bromo-4,4,4-trichloro-but-2-enoic acid methyl ester
SpectraBase Compound ID BiDmmyi9i9i
InChI InChI=1S/C5H4BrCl3O2/c1-11-4(10)3(6)2-5(7,8)9/h2H,1H3/b3-2+
InChIKey NWQRKKYXJFWTHB-NSCUHMNNSA-N
Mol Weight 282.35 g/mol
Molecular Formula C5H4BrCl3O2
Exact Mass 279.846025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JrMQNp3t02
Name (E)-2-bromo-4,4,4-trichloro-2-butenoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H4BrCl3O2
InChI InChI=1S/C5H4BrCl3O2/c1-11-4(10)3(6)2-5(7,8)9/h2H,1H3/b3-2+
InChIKey NWQRKKYXJFWTHB-NSCUHMNNSA-N
Molecular Weight 282.348 g/mol
SMILES C(\C=C/(C(=O)OC)Br)(Cl)(Cl)Cl
SPLASH splash10-05tb-1590000000-bb117a40a74ebc58025a
Source of Spectrum O1-35-1443-1
Synonyms (E)-2-bromo-4,4,4-trichloro-but-2-enoic acid methyl ester Methyl (E)-2-bromanyl-4,4,4-tris(chloranyl)but-2-enoate Methyl (E)-2-bromo-4,4,4-trichloro-but-2-enoate
Wiley ID 819616