| SpectraBase Compound ID | 4TLQbngWunQ |
|---|---|
| InChI | InChI=1S/C6H13ClO/c1-2-3-5-8-6-4-7/h2-6H2,1H3 |
| InChIKey | OJMVRGXLTANFRG-UHFFFAOYSA-N |
| Mol Weight | 136.62 g/mol |
| Molecular Formula | C6H13ClO |
| Exact Mass | 136.065493 g/mol |
| SpectraBase Spectrum ID | 9a0DgizlVpI |
|---|---|
| Name | Butyl 2-chloroethyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 136.065492738 u |
| Formula | C6H13ClO |
| InChI | InChI=1S/C6H13ClO/c1-2-3-5-8-6-4-7/h2-6H2,1H3 |
| InChIKey | OJMVRGXLTANFRG-UHFFFAOYSA-N |
| Molecular Weight | 136.622 g/mol |
| SMILES | CCCCOCCCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9671 |