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Methyl (Z)-3-(4-bromophenyl)-2-isocyanoacrylate
SpectraBase Compound ID 3M8WOe9PyIM
InChI InChI=1S/C11H8BrNO2/c1-15-11(14)9(7-13)6-8-2-4-10(12)5-3-8/h2-6H,1H3/b9-6+
InChIKey PDCJTVLFFQUQGC-RMKNXTFCSA-N
Mol Weight 266.09 g/mol
Molecular Formula C11H8BrNO2
Exact Mass 264.973841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D16VuoitwrU
Name Methyl (Z)-3-(4-bromophenyl)-2-isocyanoacrylate
Alternate Name(s) (E)-methyl 3-(4-bromophenyl)-2-cyanoacrylate (E)-3-(4-bromophenyl)-2-cyano-2-propenoic acid methyl ester Methyl (E)-3-(4-bromophenyl)-2-cyanoprop-2-enoate Methyl (E)-3-(4-bromophenyl)-2-cyano-prop-2-enoate
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Formula C11H8BrNO2
InChI InChI=1S/C11H8BrNO2/c1-15-11(14)9(7-13)6-8-2-4-10(12)5-3-8/h2-6H,1H3/b9-6+
InChIKey PDCJTVLFFQUQGC-RMKNXTFCSA-N
Literature Reference DOI 10.1039/c4cc06427e
Molecular Weight 266.094 g/mol
SMILES c1(ccc(cc1)Br)\C=C/(C#N)C(OC)=O
SPLASH splash10-00n0-0940000000-416602b84fc526f06be0
Source of Spectrum KD-50-13485/SMS6-1k
Wiley ID 1754915