SpectraBase Compound ID | Kk5ZqZZFCPI |
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InChI | InChI=1S/C12H7N3O4/c16-11-9-5-10(19-12(9)14-6-13-11)7-1-3-8(4-2-7)15(17)18/h1-6H,(H,13,14,16) |
InChIKey | GXALJKRYGUVIJK-UHFFFAOYSA-N |
Mol Weight | 257.2 g/mol |
Molecular Formula | C12H7N3O4 |
Exact Mass | 257.043656 g/mol |
SpectraBase Spectrum ID | DWmRgoM1aJP |
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Name | 6-(4-nitrophenyl)-3H-furo[2,3-d]pyrimidin-4-one |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H7N3O4 |
InChI | InChI=1S/C12H7N3O4/c16-11-9-5-10(19-12(9)14-6-13-11)7-1-3-8(4-2-7)15(17)18/h1-6H,(H,13,14,16) |
InChIKey | GXALJKRYGUVIJK-UHFFFAOYSA-N |
Molecular Weight | 257.205 g/mol |
SMILES | Oc1c2c(ncn1)oc(c2)-c1ccc(cc1)N(=O)=O |
SPLASH | splash10-0a4i-0290000000-169b65c3dd8eafcaeef9 |
Source of Spectrum | H-87-968-17 |
Wiley ID | 1563732 |