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(4E)-2-(2,4-dimethylphenyl)-4-[(4-iodoanilino)methylene]-5-methyl-2-pyrazolin-3-one
SpectraBase Compound ID 1TOm9rEkVCl
InChI InChI=1S/C19H18IN3O/c1-12-4-9-18(13(2)10-12)23-19(24)17(14(3)22-23)11-21-16-7-5-15(20)6-8-16/h4-11,21H,1-3H3/b17-11+
InChIKey ZHJOVFQZIBXZID-GZTJUZNOSA-N
Mol Weight 431.28 g/mol
Molecular Formula C19H18IN3O
Exact Mass 431.049457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oQE2np8P34
Name (4E)-2-(2,4-dimethylphenyl)-4-[(4-iodoanilino)methylene]-5-methyl-2-pyrazolin-3-one
Alternate Name(s) (4E)-2-(2,4-dimethylphenyl)-4-[(4-iodoanilino)methylene]-5-methyl-pyrazol-3-one (4E)-2-(2,4-dimethylphenyl)-4-[(4-iodoanilino)methylidene]-5-methyl-3-pyrazolone (4E)-2-(2,4-dimethylphenyl)-4-[(4-iodoanilino)methylidene]-5-methylpyrazol-3-one (4E)-2-(2,4-dimethylphenyl)-4-[[(4-iodophenyl)amino]methylidene]-5-methyl-pyrazol-3-one
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Formula C19H18IN3O
InChI InChI=1S/C19H18IN3O/c1-12-4-9-18(13(2)10-12)23-19(24)17(14(3)22-23)11-21-16-7-5-15(20)6-8-16/h4-11,21H,1-3H3/b17-11+
InChIKey ZHJOVFQZIBXZID-GZTJUZNOSA-N
Molecular Weight 431.277 g/mol
SMILES N(\C=C\1C(N(c2c(cc(C)cc2)C)N=C1C)=O)c1ccc(I)cc1
SPLASH splash10-001i-1210900000-0201a8109f3266bafd2b
Wiley ID 1459013