| SpectraBase Spectrum ID |
E048CQqu4md |
| Name |
4-(2,6-Dimethylhept-2-yl)-phenol |
| 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/c1-12(2)6-5-11-15(3,4)13-7-9-14(16)10-8-13/h7-10,12,16H,5-6,11H2,1-4H3 |
| InChIKey |
INFJVYKPPXZLJX-UHFFFAOYSA-N |
| Molecular Weight |
220.356 g/mol |
| SMILES |
C1(O)=CC=C(C(C)(C)CCCC(C)C)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962954 |