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Methyl (Z)-3-(4-chlorophenyl)-2-isocyanoacrylate
SpectraBase Compound ID DdUN5B7fHvL
InChI InChI=1S/C11H8ClNO2/c1-15-11(14)9(7-13)6-8-2-4-10(12)5-3-8/h2-6H,1H3/b9-6+
InChIKey PZMKZVIGENYNFE-RMKNXTFCSA-N
Mol Weight 221.64 g/mol
Molecular Formula C11H8ClNO2
Exact Mass 221.024356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CersRYz3DF8
Name Methyl (Z)-3-(4-chlorophenyl)-2-isocyanoacrylate
Alternate Name(s) (E)-methyl 3-(4-chlorophenyl)-2-cyanoacrylate (E)-3-(4-chlorophenyl)-2-cyano-2-propenoic acid methyl ester Methyl (E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoate Methyl (E)-3-(4-chlorophenyl)-2-cyano-prop-2-enoate
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Formula C11H8ClNO2
InChI InChI=1S/C11H8ClNO2/c1-15-11(14)9(7-13)6-8-2-4-10(12)5-3-8/h2-6H,1H3/b9-6+
InChIKey PZMKZVIGENYNFE-RMKNXTFCSA-N
Literature Reference DOI 10.1039/c4cc06427e
Molecular Weight 221.643 g/mol
SMILES c1(ccc(cc1)Cl)\C=C/(C#N)C(OC)=O
SPLASH splash10-01p9-0920000000-3c482fb3867e6cdce062
Source of Spectrum KD-50-13485/SMS6-1j
Wiley ID 1754914