| SpectraBase Compound ID | HJVQ7bHjTSw |
|---|---|
| InChI | InChI=1S/C17H18N2O5S/c1-10-8-19(17(22)18-15(10)20)14-7-13(25)12(24-14)9-23-16(21)11-5-3-2-4-6-11/h2-6,8,12-14,25H,7,9H2,1H3,(H,18,20,22)/t12-,13+,14-/m1/s1 |
| InChIKey | XKZBTZSJLNBPEY-HZSPNIEDSA-N |
| Mol Weight | 362.4 g/mol |
| Molecular Formula | C17H18N2O5S |
| Exact Mass | 362.093643 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9gFWahqgFAf |
|---|---|
| Name | 5'-O-BENZOYL-3'-DEOXY-3'-MERCAPTOTHYMIDINE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H18N2O5S |
| InChI | InChI=1S/C17H18N2O5S/c1-10-8-19(17(22)18-15(10)20)14-7-13(25)12(24-14)9-23-16(21)11-5-3-2-4-6-11/h2-6,8,12-14,25H,7,9H2,1H3,(H,18,20,22)/t12-,13+,14-/m1/s1 |
| InChIKey | XKZBTZSJLNBPEY-HZSPNIEDSA-N |
| Literature Reference Author | A.A.EL-BARBARY,A.I.KHODAIR,E.B.PEDERSEN,C.NIELSEN |
| Literature Reference Citation | MH.CHEM.,125,1017(1994) |
| Literature Reference DOI | 10.1007/BF00812717 |
| Molecular Weight | 362.400 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPR1958 |