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1H-Pyrrolo[2,3-d]pyrimidine-2,4,6(3H)-trione, 5,7-dihydro-1,3-dimethyl-5-(2-pyrimidinylamino)-5-(trifluoromethyl)-
SpectraBase Compound ID 47839GgORDY
InChI InChI=1S/C13H11F3N6O3/c1-21-7-6(8(23)22(2)11(21)25)12(9(24)19-7,13(14,15)16)20-10-17-4-3-5-18-10/h3-5H,1-2H3,(H,19,24)(H,17,18,20)
InChIKey JOTZOAJYQHFKMT-UHFFFAOYSA-N
Mol Weight 356.27 g/mol
Molecular Formula C13H11F3N6O3
Exact Mass 356.084473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkLkxfI4Zvq
Name 1H-Pyrrolo[2,3-d]pyrimidine-2,4,6(3H)-trione, 5,7-dihydro-1,3-dimethyl-5-(2-pyrimidinylamino)-5-(trifluoromethyl)-
Alternate Name(s) 1,3-Dimethyl-5-(2-pyrimidinylamino)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione 1,3-Dimethyl-5-(pyrimidin-2-ylamino)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11F3N6O3
InChI InChI=1S/C13H11F3N6O3/c1-21-7-6(8(23)22(2)11(21)25)12(9(24)19-7,13(14,15)16)20-10-17-4-3-5-18-10/h3-5H,1-2H3,(H,19,24)(H,17,18,20)
InChIKey JOTZOAJYQHFKMT-UHFFFAOYSA-N
Molecular Weight 356.265 g/mol
SMILES N1C(C(C=2C(N(C(N(C12)C)=O)C)=O)(C(F)(F)F)Nc1ncccn1)=O
SPLASH splash10-053i-9682000000-9e502cb3e3f8d0f2b4f7
Source of Spectrum IY-1-4499-6
Wiley ID 1652979