| SpectraBase Spectrum ID |
3SWJXc0UfH8 |
| Name |
D-Arabino-hexitol, 1,5-anhydro-2,6-dideoxy-, 3-[.alpha.-methoxy-.alpha.-(trifluoromethyl)benzeneacetate], (S)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.118458196 u |
| Formula |
C16H19F3O5 |
| InChI |
InChI=1S/C16H19F3O5/c1-10-13(20)12(8-9-23-10)24-14(21)15(22-2,16(17,18)19)11-6-4-3-5-7-11/h3-7,10,12-13,20H,8-9H2,1-2H3/t10-,12-,13+,15?/m0/s1 |
| InChIKey |
FMBJICCCUQJULC-ZOKQIPHBSA-N |
| Molecular Weight |
348.318 g/mol |
| SMILES |
C(C(O[C@@]1([C@@]([C@](C)(OCC1)[H])(O)[H])[H])=O)(C(F)(F)F)(C=1C=CC=CC1)OC |
![D-Arabino-hexitol, 1,5-anhydro-2,6-dideoxy-, 3-[.alpha.-methoxy-.alpha.-(trifluoromethyl)benzeneacetate], (S)-](/api/spectrum/3SWJXc0UfH8/structure.png?h=300&w=458 "D-Arabino-hexitol, 1,5-anhydro-2,6-dideoxy-, 3-[.alpha.-methoxy-.alpha.-(trifluoromethyl)benzeneacetate], (S)-")
