| SpectraBase Compound ID | trZdqrdhoM |
|---|---|
| InChI | InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16/h9-10,12-13,16H,2-8,11H2,1H3 |
| InChIKey | SNQQPOLDUKLAAF-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 | 44dJs4gEp7r |
|---|---|
| Name | Nonylphenol isomer |
| 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/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16/h9-10,12-13,16H,2-8,11H2,1H3 |
| InChIKey | SNQQPOLDUKLAAF-UHFFFAOYSA-N |
| Molecular Weight | 220.356 g/mol |
| SMILES | C=1(C(CCCCCCCCC)=CC=CC1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959609 |