SpectraBase Spectrum ID |
Ffg9H2nlFy9 |
Name |
6-Azauridine, 2',3',5'-tri-o-acetyl-4-thio- |
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(21)16-10(26)4-15-17/h4,9,11-13H,5H2,1-3H3,(H,16,21,26) |
InChIKey |
PZKMCJFYHILVJG-UHFFFAOYSA-N |
Molecular Weight |
387.363 g/mol |
SMILES |
C1(C(C(COC(C)=O)OC1N1C(NC(C=N1)=S)=O)OC(=O)C)OC(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963714 |