| SpectraBase Spectrum ID |
Dd2DHNQnEhw |
| Name |
1,6-di-o-(Ethoxyethoxy)pseudo-D-arabinopyranose [2,3-dibenzyloxy-1-(ethoxyethoxy)-5-(ethoxyethoxymethyl)cyclopentane] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
472.282489002 u |
| Formula |
C28H40O6 |
| InChI |
InChI=1S/C28H40O6/c1-3-29-15-16-31-22-25-19-26(32-18-17-30-4-2)28(34-21-24-13-9-6-10-14-24)27(25)33-20-23-11-7-5-8-12-23/h5-14,25-28H,3-4,15-22H2,1-2H3/t25-,26+,27-,28-/m1/s1 |
| InChIKey |
QDRWVXPQUJDXDX-JUDWXZBOSA-N |
| Molecular Weight |
472.622 g/mol |
| SMILES |
[C@]1([C@@]([C@@](COCCOCC)(C[C@@]1(OCCOCC)[H])[H])(OCC1=CC=CC=C1)[H])(OCC=1C=CC=CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971439 |