| SpectraBase Spectrum ID |
2QtEod5zEC6 |
| Name |
1,2-o-Isopropylidene-3-o-(p-phenylbenzyl)-.beta.-D-fructopyranose |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.172938551 u |
| Formula |
C22H26O6 |
| InChI |
InChI=1S/C22H26O6/c1-21(2)27-14-22(28-21)20(19(24)18(23)13-26-22)25-12-15-8-10-17(11-9-15)16-6-4-3-5-7-16/h3-11,18-20,23-24H,12-14H2,1-2H3/t18-,19-,20+,22+/m1/s1 |
| InChIKey |
PSNXCBZCCQRZAX-JBPLPALLSA-N |
| Molecular Weight |
386.444 g/mol |
| SMILES |
[C@@]12([C@]([C@](O)([C@@](CO2)(O)[H])[H])(OCC=2C=CC(=CC2)C2=CC=CC=C2)[H])OC(C)(C)OC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882006 |
