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(E)-Methyl HYdrogen (.alpha.-Bromo-p-methylbenzylidene)malonate
SpectraBase Compound ID 4Ep2yYhY3Oa
InChI InChI=1S/C12H11BrO4/c1-7-3-5-8(6-4-7)10(13)9(11(14)15)12(16)17-2/h3-6H,1-2H3,(H,14,15)/b10-9+
InChIKey PCZGIDMDHSIQLF-MDZDMXLPSA-N
Mol Weight 299.12 g/mol
Molecular Formula C12H11BrO4
Exact Mass 297.984072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9qibUKYOc0F
Name (E)-Methyl HYdrogen (.alpha.-Bromo-p-methylbenzylidene)malonate
CAS Registry Number 110242-30-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11BrO4
InChI InChI=1S/C12H11BrO4/c1-7-3-5-8(6-4-7)10(13)9(11(14)15)12(16)17-2/h3-6H,1-2H3,(H,14,15)/b10-9+
InChIKey PCZGIDMDHSIQLF-MDZDMXLPSA-N
Molecular Weight 299.120 g/mol
SMILES OC(\C(=C\(c1ccc(cc1)C)Br)C(=O)OC)=O
SPLASH splash10-00mo-0930000000-341f85baa52a0b468918
Source of Spectrum C-109-6707-10
Synonyms (2E)-3-bromo-2-(methoxycarbonyl)-3-(4-methylphenyl)-2-propenoic acid
Wiley ID 1300527