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4-(2-Cyano-3-(4-cyanophenyl)acrylamide)benzoic acid
SpectraBase Compound ID 48zsFXB5iTI
InChI InChI=1S/C18H11N3O3/c19-10-13-3-1-12(2-4-13)9-15(11-20)17(22)21-16-7-5-14(6-8-16)18(23)24/h1-9H,(H,21,22)(H,23,24)
InChIKey RSEWQLNHAZMHLV-UHFFFAOYSA-N
Mol Weight 317.3 g/mol
Molecular Formula C18H11N3O3
Exact Mass 317.080041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ElY6M9NyM8
Name 4-(2-Cyano-3-(4-cyanophenyl)acrylamide)benzoic acid
Appearance Yellow crystals
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Formula C18H11N3O3
InChI InChI=1S/C18H11N3O3/c19-10-13-3-1-12(2-4-13)9-15(11-20)17(22)21-16-7-5-14(6-8-16)18(23)24/h1-9H,(H,21,22)(H,23,24)
InChIKey RSEWQLNHAZMHLV-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/aoc.6893
Molecular Weight 317.304 g/mol
SMILES N(C(C(C#N)=Cc1ccc(cc1)C#N)=O)c1ccc(C(=O)O)cc1
SPLASH splash10-0hk9-9311000000-7b44a83f76b8a67d9821
Source of Spectrum AOC-36-SM26-AM-1
Wiley ID 1880568