| SpectraBase Spectrum ID |
LjE3ewfRAFh |
| Name |
(3S)-3-(Benzyloxy)hexan-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
208.146329882 u |
| Formula |
C13H20O2 |
| InChI |
InChI=1S/C13H20O2/c1-2-6-13(9-10-14)15-11-12-7-4-3-5-8-12/h3-5,7-8,13-14H,2,6,9-11H2,1H3/t13-/m0/s1 |
| InChIKey |
RGTQQOMYVIQBFL-ZDUSSCGKSA-N |
| Molecular Weight |
208.301 g/mol |
| SMILES |
C(O[C@](CCO)(CCC)[H])C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.857822 |
