![5-[1-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-URACIL-5-YL-METHYLENE]-2-THIO-HYDANTOIN](/api/spectrum/4w8rYXbyNpo/structure.png?h=300&w=458 "5-[1-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-URACIL-5-YL-METHYLENE]-2-THIO-HYDANTOIN")
| SpectraBase Compound ID | 7HeB9kIfZW4 |
|---|---|
| InChI | InChI=1S/C13H14N4O6S/c18-4-8-7(19)2-9(23-8)17-3-5(10(20)16-13(17)22)1-6-11(21)15-12(24)14-6/h1,3,7-9,18-19H,2,4H2,(H,16,20,22)(H2,14,15,21,24)/b6-1-/t7-,8+,9+/m1/s1 |
| InChIKey | ZVJFUEBQZPAAIW-FBZFWRRVSA-N |
| Mol Weight | 354.34 g/mol |
| Molecular Formula | C13H14N4O6S |
| Exact Mass | 354.063405 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4w8rYXbyNpo |
|---|---|
| Name | 5-[1-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-URACIL-5-YL-METHYLENE]-2-THIO-HYDANTOIN |
| Compound Number | 8A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H14N4O6S |
| InChI | InChI=1S/C13H14N4O6S/c18-4-8-7(19)2-9(23-8)17-3-5(10(20)16-13(17)22)1-6-11(21)15-12(24)14-6/h1,3,7-9,18-19H,2,4H2,(H,16,20,22)(H2,14,15,21,24)/b6-1-/t7-,8+,9+/m1/s1 |
| InChIKey | ZVJFUEBQZPAAIW-FBZFWRRVSA-N |
| Literature Reference Author | A.A.EL-BARBARY,A.I.KHODAIR,E.B.PEDERSEN,C.NIELSEN |
| Literature Reference Citation | MH.CHEM.,125,593(1994) |
| Literature Reference DOI | 10.1007/BF00811853 |
| Molecular Weight | 354.337 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSK1087 |