| SpectraBase Compound ID | 1pSZ4cp679s |
|---|---|
| InChI | InChI=1S/C15H24O/c1-13(2)7-5-3-4-6-8-14-9-11-15(16)12-10-14/h9-13,16H,3-8H2,1-2H3 |
| InChIKey | JSFITYFUKSFPBZ-UHFFFAOYSA-N |
| Mol Weight | 220.36 g/mol |
| Molecular Formula | C15H24O |
| Exact Mass | 220.182715 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HrgMkO4z0BO |
|---|---|
| Name | 4-(7-Methyloctyl)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/c1-13(2)7-5-3-4-6-8-14-9-11-15(16)12-10-14/h9-13,16H,3-8H2,1-2H3 |
| InChIKey | JSFITYFUKSFPBZ-UHFFFAOYSA-N |
| Molecular Weight | 220.356 g/mol |
| SMILES | CC(C)CCCCCCC1=CC=C(O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951331 |