| SpectraBase Compound ID | H7EpA1t7z6b |
|---|---|
| InChI | InChI=1S/C22H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-16-18-21(19-17-20)22(23)24/h16-19H,2-15H2,1H3,(H,23,24) |
| InChIKey | UNWMYCGHDMYGRF-UHFFFAOYSA-N |
| Mol Weight | 332.5 g/mol |
| Molecular Formula | C22H36O2 |
| Exact Mass | 332.27153 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KEyWODEHkLe |
|---|---|
| Name | p-Pentadecylbenzoic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.271530397 u |
| Formula | C22H36O2 |
| InChI | InChI=1S/C22H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-16-18-21(19-17-20)22(23)24/h16-19H,2-15H2,1H3,(H,23,24) |
| InChIKey | UNWMYCGHDMYGRF-UHFFFAOYSA-N |
| SMILES | OC(C1=CC=C(C=C1)CCCCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.977832 |