SpectraBase Spectrum ID |
7eKzDQKTkBv |
Name |
(2R,3S)-3-[(2-Methoxyethoxy)methoxy]-1,2,4-butanetriol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
210.110338294 u |
Formula |
C8H18O6 |
InChI |
InChI=1S/C8H18O6/c1-12-2-3-13-6-14-8(5-10)7(11)4-9/h7-11H,2-6H2,1H3/t7-,8+/m1/s1 |
InChIKey |
AJGCZHBPZOAQPV-SFYZADRCSA-N |
Molecular Weight |
210.226 g/mol |
SMILES |
[C@]([C@@](OCOCCOC)(CO)[H])(O)(CO)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968352 |