| SpectraBase Spectrum ID |
NLbtR6Drd |
| Name |
D-(+)-glucuronic acid .gamma.-lactone, tris(trifluoroacetate) (isomer 1) |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
463.978985199 u |
| Formula |
C12H5F9O9 |
| InChI |
InChI=1S/C12H5F9O9/c13-10(14,15)7(23)28-3-1-2(26-5(3)22)4(29-8(24)11(16,17)18)6(27-1)30-9(25)12(19,20)21/h1-4,6H |
| InChIKey |
JTNJEXCWPOHXIX-UHFFFAOYSA-N |
| Molecular Weight |
464.149 g/mol |
| SMILES |
C12OC(OC(C(F)(F)F)=O)C(C2OC(C1OC(C(F)(F)F)=O)=O)OC(C(F)(F)F)=O |
