| SpectraBase Spectrum ID |
GEvaxvZxubi |
| Name |
(2S,2'S)-1-(6-Benzyloxy-2,5,7,8-tetramethylchroman-2-yl)ethane-1,2-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
356.198759378 u |
| Formula |
C22H28O4 |
| InChI |
InChI=1S/C22H28O4/c1-14-15(2)21-18(10-11-22(4,26-21)19(24)12-23)16(3)20(14)25-13-17-8-6-5-7-9-17/h5-9,19,23-24H,10-13H2,1-4H3/t19-,22+/m1/s1 |
| InChIKey |
IECIQXURBYXVJO-KNQAVFIVSA-N |
| Molecular Weight |
356.462 g/mol |
| SMILES |
C1=2O[C@@]([C@](O)(CO)[H])(C)CCC2C(C)=C(C(=C1C)C)OCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.819649 |
