| SpectraBase Spectrum ID |
6cnEnDI3glC |
| Name |
2-Ethyl-1-(2-hydroxymethylphenyl)-2-butanol |
| 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/c1-3-13(15,4-2)9-11-7-5-6-8-12(11)10-14/h5-8,14-15H,3-4,9-10H2,1-2H3 |
| InChIKey |
JTSNOPVILYOUGD-UHFFFAOYSA-N |
| Molecular Weight |
208.301 g/mol |
| SMILES |
C=1(CC(O)(CC)CC)C(CO)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.824142 |
