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4-[(2Z)-6-amino-5-cyano-2-ethylidene-3-methyl-4,4-bis(trifluoromethyl)-3H-pyridin-1-yl]benzamide
SpectraBase Compound ID 7Hf3iArhhka
InChI InChI=1S/C18H16F6N4O/c1-3-13-9(2)16(17(19,20)21,18(22,23)24)12(8-25)14(26)28(13)11-6-4-10(5-7-11)15(27)29/h3-7,9H,26H2,1-2H3,(H2,27,29)/b13-3-
InChIKey JBYIIUHIBQODFE-DXNYSGJVSA-N
Mol Weight 418.34 g/mol
Molecular Formula C18H16F6N4O
Exact Mass 418.12283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1T1Si44zXXs
Name 4-[(2Z)-6-amino-5-cyano-2-ethylidene-3-methyl-4,4-bis(trifluoromethyl)-3H-pyridin-1-yl]benzamide
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Formula C18H16F6N4O
InChI InChI=1S/C18H16F6N4O/c1-3-13-9(2)16(17(19,20)21,18(22,23)24)12(8-25)14(26)28(13)11-6-4-10(5-7-11)15(27)29/h3-7,9H,26H2,1-2H3,(H2,27,29)/b13-3-
InChIKey JBYIIUHIBQODFE-DXNYSGJVSA-N
Molecular Weight 418.343 g/mol
SMILES NC1=C(C(C(\C(N1c1ccc(C(=O)N)cc1)=C\C)C)(C(F)(F)F)C(F)(F)F)C#N
SPLASH splash10-0002-4849100000-6fafc6522e00f61c3472
Synonyms 4-[(2Z)-6-azanyl-5-cyano-2-ethylidene-3-methyl-4,4-bis(trifluoromethyl)-3H-pyridin-1-yl]benzamide
Wiley ID 1454810