| SpectraBase Spectrum ID |
KkZ9uzhOl5H |
| Name |
4-N-Amyl-2-(alpha-methyl-N-butyl)-phenol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.198365456 u |
| Formula |
C16H26O |
| InChI |
InChI=1S/C16H26O/c1-4-6-7-9-14-10-11-16(17)15(12-14)13(3)8-5-2/h10-13,17H,4-9H2,1-3H3 |
| InChIKey |
KUFMWFCXCRUDTB-UHFFFAOYSA-N |
| Molecular Weight |
234.383 g/mol |
| SMILES |
C=1(C(=CC(=CC1)CCCCC)C(CCC)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904653 |
