| SpectraBase Spectrum ID |
Dx3yBsBfznO |
| Name |
1-[2-[2H,4H-1,2,4-Triazin-3-thione-5-one]], 1-deoxy-2,3,5-o-triacetyl-pentofuranosyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
387.073635685 u |
| Formula |
C14H17N3O8S |
| InChI |
InChI=1S/C14H17N3O8S/c1-6(18)22-5-9-11(23-7(2)19)12(24-8(3)20)13(25-9)17-14(26)16-10(21)4-15-17/h4,9,11-13H,5H2,1-3H3,(H,16,21,26) |
| InChIKey |
OHFWDWWWABZRBH-UHFFFAOYSA-N |
| Molecular Weight |
387.363 g/mol |
| SMILES |
C1(C(C(COC(C)=O)OC1N1N=CC(NC1=S)=O)OC(=O)C)OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963776 |
![1-[2-[2H,4H-1,2,4-Triazin-3-thione-5-one]], 1-deoxy-2,3,5-o-triacetyl-pentofuranosyl](/api/spectrum/Dx3yBsBfznO/structure.png?h=300&w=458 "1-[2-[2H,4H-1,2,4-Triazin-3-thione-5-one]], 1-deoxy-2,3,5-o-triacetyl-pentofuranosyl")
