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6,7-Dihydro-4-phenyl-N-[3-(trifluoromethyl)phenyl]-6-[((3-trifluoromethyl)phenyl)amino]-5H-2-pyridinecarboxamide
SpectraBase Compound ID KdFJa44ApFa
InChI InChI=1S/C29H21F6N3O/c30-28(31,32)18-9-4-11-20(15-18)36-26-24(17-7-2-1-3-8-17)22-13-6-14-23(22)25(38-26)27(39)37-21-12-5-10-19(16-21)29(33,34)35/h1-5,7-12,15-16H,6,13-14H2,(H,36,38)(H,37,39)
InChIKey FWJOTXMAILAKBW-UHFFFAOYSA-N
Mol Weight 541.5 g/mol
Molecular Formula C29H21F6N3O
Exact Mass 541.158881 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LvAlQwo6AOz
Name 6,7-Dihydro-4-phenyl-N-[3-(trifluoromethyl)phenyl]-6-[((3-trifluoromethyl)phenyl)amino]-5H-2-pyridinecarboxamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H21F6N3O
InChI InChI=1S/C29H21F6N3O/c30-28(31,32)18-9-4-11-20(15-18)36-26-24(17-7-2-1-3-8-17)22-13-6-14-23(22)25(38-26)27(39)37-21-12-5-10-19(16-21)29(33,34)35/h1-5,7-12,15-16H,6,13-14H2,(H,36,38)(H,37,39)
InChIKey FWJOTXMAILAKBW-UHFFFAOYSA-N
Molecular Weight 541.497 g/mol
SMILES N(C(c1nc(c(c2c1CCC2)-c1ccccc1)Nc1cc(C(F)(F)F)ccc1)=O)c1cc(C(F)(F)F)ccc1
SPLASH splash10-0udl-0009060000-a387dcd892b87991e741
Source of Spectrum F-52-12539-6
Synonyms 4-phenyl-3-[3-(trifluoromethyl)anilino]-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide 4-phenyl-N-[3-(trifluoromethyl)phenyl]-3-[[3-(trifluoromethyl)phenyl]amino]-6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxamide
Wiley ID 798926