| SpectraBase Compound ID | I0yMzO2MtHx |
|---|---|
| InChI | InChI=1S/C8H16Cl2/c9-7-5-3-1-2-4-6-8-10/h1-8H2 |
| InChIKey | WXYMNDFVLNUAIA-UHFFFAOYSA-N |
| Mol Weight | 183.12 g/mol |
| Molecular Formula | C8H16Cl2 |
| Exact Mass | 182.062906 g/mol |
| SpectraBase Spectrum ID | GCDPmQucSnu |
|---|---|
| Name | 1,8-Dichlorooctane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.062905915 u |
| Formula | C8H16Cl2 |
| InChI | InChI=1S/C8H16Cl2/c9-7-5-3-1-2-4-6-8-10/h1-8H2 |
| InChIKey | WXYMNDFVLNUAIA-UHFFFAOYSA-N |
| Molecular Weight | 183.122 g/mol |
| SMILES | C(Cl)CCCCCCCCl |
| Spectrum/Structure Validation Score (Raman) | 0.987665 |