SpectraBase Spectrum ID |
5AVwlERp0xy |
Name |
3-(3-Isopropyl-4-methoxy-phenyl)propan-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/c1-10(2)12-9-11(5-4-8-14)6-7-13(12)15-3/h6-7,9-10,14H,4-5,8H2,1-3H3 |
InChIKey |
UYBHQOADHAEKRW-UHFFFAOYSA-N |
Molecular Weight |
208.301 g/mol |
SMILES |
C=1(C(=CC=C(C1)CCCO)OC)C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979406 |