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6-Amino-5-cyano-2-ethoxy-4-(4-nitrophenyl)-2-(trifluoromethyl)-3,4-dihydropyran-3-carboxylic acid ethyl ester
SpectraBase Compound ID KNobmZZFrYn
InChI InChI=1S/C18H18F3N3O6/c1-3-28-16(25)14-13(10-5-7-11(8-6-10)24(26)27)12(9-22)15(23)30-17(14,29-4-2)18(19,20)21/h5-8,13-14H,3-4,23H2,1-2H3
InChIKey JLFMQDCAVMVOSA-UHFFFAOYSA-N
Mol Weight 429.35 g/mol
Molecular Formula C18H18F3N3O6
Exact Mass 429.11477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXxVhpAkKrp
Name 6-Amino-5-cyano-2-ethoxy-4-(4-nitrophenyl)-2-(trifluoromethyl)-3,4-dihydropyran-3-carboxylic acid ethyl ester
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Formula C18H18F3N3O6
InChI InChI=1S/C18H18F3N3O6/c1-3-28-16(25)14-13(10-5-7-11(8-6-10)24(26)27)12(9-22)15(23)30-17(14,29-4-2)18(19,20)21/h5-8,13-14H,3-4,23H2,1-2H3
InChIKey JLFMQDCAVMVOSA-UHFFFAOYSA-N
Molecular Weight 429.352 g/mol
SMILES NC1=C(C(C(C(O1)(C(F)(F)F)OCC)C(=O)OCC)c1ccc(cc1)N(=O)=O)C#N
SPLASH splash10-0159-9004400000-91524054a35e51af8f74
Source of Spectrum F-62-2262-3
Synonyms Ethyl 6-amino-5-cyano-2-ethoxy-4-(4-nitrophenyl)-2-(trifluoromethyl)-3,4-dihydropyran-3-carboxylate Ethyl 6-azanyl-5-cyano-2-ethoxy-4-(4-nitrophenyl)-2-(trifluoromethyl)-3,4-dihydropyran-3-carboxylate
Wiley ID 1632448