| SpectraBase Spectrum ID |
I7gIrg8Aj8F |
| Name |
.beta.-D-Glucopyranoside, 2-phenylethyl 2-o-.beta.-D-xylopyranosyl-, hexamethyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
500.262147478 u |
| Formula |
C25H40O10 |
| InChI |
InChI=1S/C25H40O10/c1-26-14-18-20(29-4)21(30-5)23(25(34-18)32-13-12-16-10-8-7-9-11-16)35-24-22(31-6)19(28-3)17(27-2)15-33-24/h7-11,17-25H,12-15H2,1-6H3/t17-,18-,19+,20-,21+,22-,23-,24+,25-/m1/s1 |
| InChIKey |
PTFPUZOIZHLJJT-YYKHDYSTSA-N |
| Molecular Weight |
500.585 g/mol |
| SMILES |
[C@@]1(OCCC2=CC=CC=C2)([C@](O[C@]2([C@](OC)([C@@](OC)([C@](OC)(CO2)[H])[H])[H])[H])([C@@](OC)([C@](OC)([C@](O1)(COC)[H])[H])[H])[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870217 |
