SpectraBase Spectrum ID |
A7nzzEXoDRX |
Name |
Butyl 2,3,4,6-tetradeoxy-5-o-(trifluoroacetyl)-2,6-bis[(trifluoroacetyl)amino]hexonate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
506.109939801 u |
Formula |
C16H19F9N2O6 |
InChI |
InChI=1S/C16H19F9N2O6/c1-2-3-6-32-10(28)9(27-12(30)15(20,21)22)5-4-8(33-13(31)16(23,24)25)7-26-11(29)14(17,18)19/h8-9H,2-7H2,1H3,(H,26,29)(H,27,30) |
InChIKey |
WSCHNJVTHRKEON-UHFFFAOYSA-N |
Molecular Weight |
506.322 g/mol |
SMILES |
C(=O)(NCC(CCC(C(OCCCC)=O)NC(C(F)(F)F)=O)OC(C(F)(F)F)=O)C(F)(F)F |