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

*Links on SpectraBase are not permalinks.
1H-Pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-phenyl-
SpectraBase Compound ID GaWVxnRrIaE
InChI InChI=1S/C11H8N4O2/c16-10-7-8(6-4-2-1-3-5-6)14-15-9(7)12-11(17)13-10/h1-5H,(H3,12,13,14,15,16,17)
InChIKey KOZZWYKKLBHHEY-UHFFFAOYSA-N
Mol Weight 228.21 g/mol
Molecular Formula C11H8N4O2
Exact Mass 228.064726 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 8TkOmDfaHRt
Name 1H-Pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-phenyl-
Alternate Name(s) 3-Phenyl-1,2-dihydropyrazolo[3,4-d]pyrimidine-4,6-dione 3-Phenyl-1,2-dihydropyrazolo[3,4-d]pyrimidine-4,6-quinone
CAS Registry Number 42754-82-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N4O2
InChI InChI=1S/C11H8N4O2/c16-10-7-8(6-4-2-1-3-5-6)14-15-9(7)12-11(17)13-10/h1-5H,(H3,12,13,14,15,16,17)
InChIKey KOZZWYKKLBHHEY-UHFFFAOYSA-N
Molecular Weight 228.211 g/mol
SMILES N1C(NC(c2c1[nH]nc2-c1ccccc1)=O)=O
SPLASH splash10-002f-9170000000-23d2da97dbc049dafe45
Source of Spectrum Y-27-658-15
Wiley ID 1229308