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6-Amino-4-(4-chlorophenyl)-5-cyano-2-ethoxy-2-(trifluoromethyl)-3,4-dihydropyran-3-carboxylic acid ethyl ester
SpectraBase Compound ID 8Ppg0j52TcG
InChI InChI=1S/C18H18ClF3N2O4/c1-3-26-16(25)14-13(10-5-7-11(19)8-6-10)12(9-23)15(24)28-17(14,27-4-2)18(20,21)22/h5-8,13-14H,3-4,24H2,1-2H3
InChIKey IEDRTXDRQGDNCW-UHFFFAOYSA-N
Mol Weight 418.8 g/mol
Molecular Formula C18H18ClF3N2O4
Exact Mass 418.090719 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzTlvnM7hIm
Name 6-Amino-4-(4-chlorophenyl)-5-cyano-2-ethoxy-2-(trifluoromethyl)-3,4-dihydropyran-3-carboxylic acid ethyl ester
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Formula C18H18ClF3N2O4
InChI InChI=1S/C18H18ClF3N2O4/c1-3-26-16(25)14-13(10-5-7-11(19)8-6-10)12(9-23)15(24)28-17(14,27-4-2)18(20,21)22/h5-8,13-14H,3-4,24H2,1-2H3
InChIKey IEDRTXDRQGDNCW-UHFFFAOYSA-N
Molecular Weight 418.800 g/mol
SMILES NC1=C(C(C(C(O1)(C(F)(F)F)OCC)C(=O)OCC)c1ccc(cc1)Cl)C#N
SPLASH splash10-0a4i-0092100000-7417005443e61f458051
Source of Spectrum F-62-2262-3
Synonyms Ethyl 6-amino-4-(4-chlorophenyl)-5-cyano-2-ethoxy-2-(trifluoromethyl)-3,4-dihydropyran-3-carboxylate Ethyl 6-azanyl-4-(4-chlorophenyl)-5-cyano-2-ethoxy-2-(trifluoromethyl)-3,4-dihydropyran-3-carboxylate
Wiley ID 1632452