SpectraBase Spectrum ID |
HJExJeHYiBV |
Name |
2-(1'-Methyl-1'-hydroxyethyl)-6-(T-butyl)-4-methylphenol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
222.161979946 u |
Formula |
C14H22O2 |
InChI |
InChI=1S/C14H22O2/c1-9-7-10(13(2,3)4)12(15)11(8-9)14(5,6)16/h7-8,15-16H,1-6H3 |
InChIKey |
AJNMQSZVSIVKDR-UHFFFAOYSA-N |
Molecular Weight |
222.328 g/mol |
SMILES |
C=1(C(=C(C(C)(C)C)C=C(C1)C)O)C(O)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931998 |