| SpectraBase Spectrum ID |
16UX4QddNX7 |
| Name |
Benzeneethanol, 4-benzyloxy-3-ethoxy-.beta.-hydroxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.136159120 u |
| Formula |
C17H20O4 |
| InChI |
InChI=1S/C17H20O4/c1-2-20-17-10-14(15(19)11-18)8-9-16(17)21-12-13-6-4-3-5-7-13/h3-10,15,18-19H,2,11-12H2,1H3 |
| InChIKey |
PERFOKKIUNNNTL-UHFFFAOYSA-N |
| SMILES |
C1=C(C=C(C(=C1)OCC1=CC=CC=C1)OCC)C(O)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920422 |
