| SpectraBase Compound ID | KJL5smk5SzM |
|---|---|
| InChI | InChI=1S/C6H5N5O3/c7-6-10-2-1(3(12)11-6)8-4(13)5(14)9-2/h(H,8,13)(H4,7,9,10,11,12,14) |
| InChIKey | SFLOGVVDXPCWGR-UHFFFAOYSA-N |
| Mol Weight | 195.14 g/mol |
| Molecular Formula | C6H5N5O3 |
| Exact Mass | 195.039239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GVopVgKc9H6 |
|---|---|
| Name | 2-AMINO-4,6,7(3H,5H,8H)-PTERIDINETRIONE |
| Source of Sample | U. Ewers, H. Guenther Chem. Ber. 107, 876(1974) |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H5N5O3 |
| InChI | InChI=1S/C6H5N5O3/c7-6-10-2-1(3(12)11-6)8-4(13)5(14)9-2/h(H,8,13)(H4,7,9,10,11,12,14) |
| InChIKey | SFLOGVVDXPCWGR-UHFFFAOYSA-N |
| Molecular Weight | 195.14 |
| Solvent | Deuterium oxide; Reference=Dioxane; Temperature=Ambient Spectrometer= Bruker HX-90 |