| SpectraBase Compound ID | AvjWa9KfueV |
|---|---|
| InChI | InChI=1S/C15H20/c1-2-3-4-5-6-7-9-12-15-13-10-8-11-14-15/h8,10-11,13-14H,2-7H2,1H3 |
| InChIKey | ZRQWNFWWPPYNFA-UHFFFAOYSA-N |
| Mol Weight | 200.32 g/mol |
| Molecular Formula | C15H20 |
| Exact Mass | 200.156501 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 4K2epYmexk |
|---|---|
| Name | 1-Phenyl-1-nonyne |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.156500644 u |
| Formula | C15H20 |
| InChI | InChI=1S/C15H20/c1-2-3-4-5-6-7-9-12-15-13-10-8-11-14-15/h8,10-11,13-14H,2-7H2,1H3 |
| InChIKey | ZRQWNFWWPPYNFA-UHFFFAOYSA-N |
| Molecular Weight | 200.325 g/mol |
| SMILES | C=1C(=CC=CC1)C#CCCCCCCC |
| Spectrum/Structure Validation Score (Raman) | 0.991531 |