SpectraBase Spectrum ID |
1iULKWhAGMl |
Name |
(dl)-1,8-Diphenyl-4,5-octanediol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
298.193280075 u |
Formula |
C20H26O2 |
InChI |
InChI=1S/C20H26O2/c21-19(15-7-13-17-9-3-1-4-10-17)20(22)16-8-14-18-11-5-2-6-12-18/h1-6,9-12,19-22H,7-8,13-16H2 |
InChIKey |
XYYGRAJCOVSGBI-UHFFFAOYSA-N |
SMILES |
C(C(O)CCCC1=CC=CC=C1)(O)CCCC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948862 |