SpectraBase Spectrum ID |
LaWrTNCGwRi |
Name |
1-(1,1-Dimethylethoxy)-3-phenyl-2-propanol |
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/c1-13(2,3)15-10-12(14)9-11-7-5-4-6-8-11/h4-8,12,14H,9-10H2,1-3H3 |
InChIKey |
RVGYKXJVZWQQIC-UHFFFAOYSA-N |
Molecular Weight |
208.301 g/mol |
SMILES |
C(C(CC=1C=CC=CC1)O)OC(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938148 |