SpectraBase Spectrum ID |
EEbwjmUt3sU |
Name |
1-(4-Tert-butylphenyl)-3-methyl-2-butanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
220.182715392 u |
Formula |
C15H24O |
InChI |
InChI=1S/C15H24O/c1-11(2)14(16)10-12-6-8-13(9-7-12)15(3,4)5/h6-9,11,14,16H,10H2,1-5H3 |
InChIKey |
IKIPKGAKHLUWDJ-UHFFFAOYSA-N |
Molecular Weight |
220.356 g/mol |
SMILES |
C(C1=CC=C(CC(C(C)C)O)C=C1)(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951943 |