| SpectraBase Spectrum ID |
1rt728mEo9B |
| Name |
(4R,5R,4'R)-5-((R)-1-Benzyloxy-but-3-enyl)-2,2,2',2'-tetramethyl-[4,4']bi[[1,3]dioxolanyl] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.209324061 u |
| Formula |
C21H30O5 |
| InChI |
InChI=1S/C21H30O5/c1-6-10-16(22-13-15-11-8-7-9-12-15)18-19(26-21(4,5)25-18)17-14-23-20(2,3)24-17/h6-9,11-12,16-19H,1,10,13-14H2,2-5H3/t16-,17-,18-,19-/m1/s1 |
| InChIKey |
MYFDSNMTCLXYGQ-NCXUSEDFSA-N |
| Molecular Weight |
362.466 g/mol |
| SMILES |
[C@@]1([C@](OC(O1)(C)C)([C@](OCC1=CC=CC=C1)(CC=C)[H])[H])([C@@]1(OC(C)(C)OC1)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885596 |
![(4R,5R,4'R)-5-((R)-1-Benzyloxy-but-3-enyl)-2,2,2',2'-tetramethyl-[4,4']bi[[1,3]dioxolanyl]](/api/spectrum/1rt728mEo9B/structure.png?h=300&w=458 "(4R,5R,4'R)-5-((R)-1-Benzyloxy-but-3-enyl)-2,2,2',2'-tetramethyl-[4,4']bi[[1,3]dioxolanyl]")
