SpectraBase Spectrum ID |
DlvRnfxUif2 |
Name |
Glucose 5TFA |
Classification |
Chemical |
Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
659.974883479 u |
Formula |
C16H7F15O11 |
InChI |
InChI=1S/C16H7F15O11/c17-12(18,19)7(32)37-1-2-3(39-8(33)13(20,21)22)4(40-9(34)14(23,24)25)5(41-10(35)15(26,27)28)6(38-2)42-11(36)16(29,30)31/h2-6H,1H2/t2-,3-,4+,5-,6-/m1/s1 |
InChIKey |
FMTKBUZWITYHQE-VFUOTHLCSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
660.197 g/mol |
Nominal Mass |
660 u |
Quality |
981 |
Retention Index |
4515 |
SMILES |
[C@@]1([C@]([C@](O[C@@]([C@]1(OC(C(F)(F)F)=O)[H])(COC(C(F)(F)F)=O)[H])(OC(C(F)(F)F)=O)[H])(OC(C(F)(F)F)=O)[H])(OC(C(F)(F)F)=O)[H] |
SPLASH |
splash10-014i-9431000000-6ad96faef7c700072b81 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(3,4,5,6-tetrakis((trifluoroacetyl)oxy)oxan-2-yl)methyl trifluoroacetate |
Technique |
GC/MS |
Wiley ID |
DD2024_030858 |