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3-[5-(2-Chloro-5-nitro-phenyl)-furan-2-yl]-2-cyano-acrylic acid
SpectraBase Compound ID IjpXZcXi8Rt
InChI InChI=1S/C14H7ClN2O5/c15-12-3-1-9(17(20)21)6-11(12)13-4-2-10(22-13)5-8(7-16)14(18)19/h1-6H,(H,18,19)/b8-5+
InChIKey CMSYPRJCBVSSFH-VMPITWQZSA-N
Mol Weight 318.67 g/mol
Molecular Formula C14H7ClN2O5
Exact Mass 318.004349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5z2ujEffdBk
Name 3-[5-(2-Chloro-5-nitro-phenyl)-furan-2-yl]-2-cyano-acrylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H7ClN2O5
InChI InChI=1S/C14H7ClN2O5/c15-12-3-1-9(17(20)21)6-11(12)13-4-2-10(22-13)5-8(7-16)14(18)19/h1-6H,(H,18,19)/b8-5+
InChIKey CMSYPRJCBVSSFH-VMPITWQZSA-N
Molecular Weight 318.672 g/mol
SMILES OC(\C(=C\c1oc(-c2cc(N(=O)=O)ccc2Cl)cc1)C#N)=O
SPLASH splash10-014i-5936000000-b681b7e41e7e41d724f0
Synonyms (2E)-3-[5-(2-Chloro-5-nitrophenyl)-2-furyl]-2-cyano-2-propenoic acid (E)-3-[5-(2-chloranyl-5-nitro-phenyl)furan-2-yl]-2-cyano-prop-2-enoic acid (E)-3-[5-(2-chloro-5-nitro-phenyl)-2-furyl]-2-cyano-acrylic acid (E)-3-[5-(2-chloro-5-nitro-phenyl)-2-furyl]-2-cyano-prop-2-enoic acid (E)-3-[5-(2-chloro-5-nitrophenyl)-2-furanyl]-2-cyano-2-propenoic acid (E)-3-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-2-cyanoprop-2-enoic acid
Wiley ID 1436991