| SpectraBase Compound ID | 9VGFT1TDusV |
|---|---|
| InChI | InChI=1S/C15H16O2/c1-12(16)17-11-5-9-14-8-4-7-13-6-2-3-10-15(13)14/h2-4,6-8,10H,5,9,11H2,1H3 |
| InChIKey | LSGNLCHTXFLGLD-UHFFFAOYSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C15H16O2 |
| Exact Mass | 228.11503 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | B3nQZuy2727 |
|---|---|
| Name | 1-Naphthalenepropanol, acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.115029753 u |
| Formula | C15H16O2 |
| InChI | InChI=1S/C15H16O2/c1-12(16)17-11-5-9-14-8-4-7-13-6-2-3-10-15(13)14/h2-4,6-8,10H,5,9,11H2,1H3 |
| InChIKey | LSGNLCHTXFLGLD-UHFFFAOYSA-N |
| Molecular Weight | 228.291 g/mol |
| SMILES | C=12C(=CC=CC1C=CC=C2)CCCOC(C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.709793 |