![METHYL-2-AMINO-3-METHYL-PYRROLO-[2,3-D]-PYRIMIDIN-4-ONE-5-CARBOXYLATE](/api/spectrum/1k0VrTFhdgO/structure.png?h=300&w=458 "METHYL-2-AMINO-3-METHYL-PYRROLO-[2,3-D]-PYRIMIDIN-4-ONE-5-CARBOXYLATE")
| SpectraBase Compound ID | 2H6doEajbu7 |
|---|---|
| InChI | InChI=1S/C9H10N4O3/c1-13-7(14)5-4(8(15)16-2)3-11-6(5)12-9(13)10/h3,11H,1-2H3,(H2,10,12) |
| InChIKey | XWVVXMBKNXLALW-UHFFFAOYSA-N |
| Mol Weight | 222.2 g/mol |
| Molecular Formula | C9H10N4O3 |
| Exact Mass | 222.07529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1k0VrTFhdgO |
|---|---|
| Name | METHYL-2-AMINO-3-METHYL-PYRROLO-[2,3-D]-PYRIMIDIN-4-ONE-5-CARBOXYLATE |
| Compound Number | 44 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C9H10N4O3/c1-13-7(14)5-4(8(15)16-2)3-11-6(5)12-9(13)10/h3,11H,1-2H3,(H2,10,12) |
| InChIKey | XWVVXMBKNXLALW-UHFFFAOYSA-N |
| Literature Reference | G.C.HOOPS,J.PARK,G.A.GARCIA,L.B.TOWNSEND J.HETCYCL.CHEM.,33,767(1996) |
| Solvent | Dimethyl sulfoxide-d6 |
| Technique | C/H SHIFT CORRELATION |