| SpectraBase Compound ID | 4W8hRkz9KW |
|---|---|
| InChI | InChI=1S/C7H15Cl/c1-4-5-6(2)7(3)8/h6-7H,4-5H2,1-3H3 |
| InChIKey | LMOJFQOVUHYHPF-UHFFFAOYSA-N |
| Mol Weight | 134.65 g/mol |
| Molecular Formula | C7H15Cl |
| Exact Mass | 134.086228 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Do0MJQbdFAs |
|---|---|
| Name | 2-Chloro-3-methylhexane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 134.086228183 u |
| Formula | C7H15Cl |
| InChI | InChI=1S/C7H15Cl/c1-4-5-6(2)7(3)8/h6-7H,4-5H2,1-3H3 |
| InChIKey | LMOJFQOVUHYHPF-UHFFFAOYSA-N |
| Molecular Weight | 134.650 g/mol |
| SMILES | C(Cl)(C(CCC)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.949024 |