| SpectraBase Spectrum ID |
JHXNB6kuDg0 |
| Name |
Xylitol 5TFA |
| CAS Registry Number |
26293-29-8 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
631.979968860 u |
| Formula |
C15H7F15O10 |
| InChI |
InChI=1S/C15H7F15O10/c16-11(17,18)6(31)36-1-3(38-8(33)13(22,23)24)5(40-10(35)15(28,29)30)4(39-9(34)14(25,26)27)2-37-7(32)12(19,20)21/h3-5H,1-2H2 |
| InChIKey |
VKRTZHFXBRDDBC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
632.187 g/mol |
| Nominal Mass |
632 u |
| Quality |
1000 |
| Retention Index |
4277 |
| SMILES |
C(C(OC(C(F)(F)F)=O)COC(C(F)(F)F)=O)(C(OC(C(F)(F)F)=O)COC(C(F)(F)F)=O)OC(C(F)(F)F)=O |
| SPLASH |
splash10-014i-9310000000-8282bed1793aeaadb4eb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,2,4,5-tetrakis((trifluoroacetyl)oxy)pentan-3-yl trifluoroacetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_023411 |
