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3-Phenyl-N-[2,4,6-trioxo-1-(phenylmethyl)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]propanamide
SpectraBase Compound ID 5QNOdJlxAxq
InChI InChI=1S/C23H19F3N4O4/c24-23(25,26)22(29-16(31)12-11-14-7-3-1-4-8-14)17-18(27-20(22)33)30(21(34)28-19(17)32)13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H,27,33)(H,29,31)(H,28,32,34)
InChIKey DOWVWAGVDWGDKC-UHFFFAOYSA-N
Mol Weight 472.42 g/mol
Molecular Formula C23H19F3N4O4
Exact Mass 472.13584 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUJjmJ5ptF9
Name 3-Phenyl-N-[2,4,6-trioxo-1-(phenylmethyl)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]propanamide
Alternate Name(s) 3-Phenyl-N-[2,4,6-tris(oxidanylidene)-1-(phenylmethyl)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]propanamide N-[1-benzyl-2,4,6-triketo-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-phenyl-propionamide N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-phenylpropanamide N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-phenyl-propanamide
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Formula C23H19F3N4O4
InChI InChI=1S/C23H19F3N4O4/c24-23(25,26)22(29-16(31)12-11-14-7-3-1-4-8-14)17-18(27-20(22)33)30(21(34)28-19(17)32)13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H,27,33)(H,29,31)(H,28,32,34)
InChIKey DOWVWAGVDWGDKC-UHFFFAOYSA-N
Molecular Weight 472.424 g/mol
SMILES N1C(C(C2=C1N(C(NC2=O)=O)Cc1ccccc1)(C(F)(F)F)NC(=O)CCc1ccccc1)=O
SPLASH splash10-0006-9200000000-b11bdd8e44ccc2bc970c
Wiley ID 1442756