For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(4-Methylphenyl)-5-oxidanyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione
SpectraBase Compound ID 9r3Rf5c6Qif
InChI InChI=1S/C14H10F3N3O4/c1-6-2-4-7(5-3-6)20-9-8(10(21)19-12(20)23)13(24,11(22)18-9)14(15,16)17/h2-5,24H,1H3,(H,18,22)(H,19,21,23)
InChIKey ZVQWOXPMBIKVSS-UHFFFAOYSA-N
Mol Weight 341.25 g/mol
Molecular Formula C14H10F3N3O4
Exact Mass 341.06234 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4CcNXeleZRl
Name 1-(4-Methylphenyl)-5-oxidanyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione
Alternate Name(s) 5-Hydroxy-1-(4-methylphenyl)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione 5-Hydroxy-1-(p-tolyl)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4,6-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10F3N3O4
InChI InChI=1S/C14H10F3N3O4/c1-6-2-4-7(5-3-6)20-9-8(10(21)19-12(20)23)13(24,11(22)18-9)14(15,16)17/h2-5,24H,1H3,(H,18,22)(H,19,21,23)
InChIKey ZVQWOXPMBIKVSS-UHFFFAOYSA-N
Molecular Weight 341.246 g/mol
SMILES N1C(C=2C(C(NC2N(C1=O)c1ccc(cc1)C)=O)(C(F)(F)F)O)=O
SPLASH splash10-00kf-9330000000-7a5f8ab74148801e5c01
Wiley ID 1511996