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AFYSUDAWCPZFEQ-UHFFFAOYSA-N
SpectraBase Compound ID GlCWQP3LDri
InChI InChI=1S/C14H15BrO4/c1-3-18-13(16)12(14(17)19-4-2)9-10-5-7-11(15)8-6-10/h5-9H,3-4H2,1-2H3
InChIKey AFYSUDAWCPZFEQ-UHFFFAOYSA-N
Mol Weight 327.17 g/mol
Molecular Formula C14H15BrO4
Exact Mass 326.015372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kdTQO7bHNg
Name 2-(4-bromobenzylidene)malonic acid diethyl ester
Alternate Name(s) 2-[(4-bromophenyl)methylidene]propanedioic acid diethyl ester Diethyl 2-(4-bromobenzylidene)malonate Diethyl 2-[(4-bromophenyl)methylene]propanedioate Diethyl 2-[(4-bromophenyl)methylidene]propanedioate
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Formula C14H15BrO4
InChI InChI=1S/C14H15BrO4/c1-3-18-13(16)12(14(17)19-4-2)9-10-5-7-11(15)8-6-10/h5-9H,3-4H2,1-2H3
InChIKey AFYSUDAWCPZFEQ-UHFFFAOYSA-N
Molecular Weight 327.174 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)=Cc1ccc(cc1)Br
SPLASH splash10-0kai-0910000000-055b3bd1d2cef59e0dd9
Source of Spectrum SK-25-757-3
Wiley ID 866482