SpectraBase Spectrum ID |
79AWwupzTPh |
Name |
5-Methyl-2-(7H-purin-6-yl)-1H-pyrazol-3(2H)-one |
Appearance |
Buff crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C9H8N6O |
InChI |
InChI=1S/C9H8N6O/c1-5-2-6(16)15(14-5)9-7-8(11-3-10-7)12-4-13-9/h2-4,14H,1H3,(H,10,11,12,13) |
InChIKey |
KOGDJZPFSDVJTG-UHFFFAOYSA-N |
Instrument Name |
Shimadzu GC/MS-QP-5050A |
Ionization Type |
EI Positive ion |
Literature Reference DOI |
10.1002/jhet.2969 |
Molecular Weight |
216.204 g/mol |
SMILES |
N1C(=CC(N1c1c2c(ncn1)nc[nH]2)=O)C |
SPLASH |
splash10-0v09-3900000000-5de9069a501f462292ed |
Source of Spectrum |
Y-54-SM31-22 |
Wiley ID |
1880735 |