| SpectraBase Compound ID | EV1N9XqhZg0 |
|---|---|
| InChI | InChI=1S/C10H19Cl/c1-8(2)6-9(3)7-10(4,5)11/h6,9H,7H2,1-5H3 |
| InChIKey | AQXBQTZPWWARIL-UHFFFAOYSA-N |
| Mol Weight | 174.71 g/mol |
| Molecular Formula | C10H19Cl |
| Exact Mass | 174.117528 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GxqTs7DpPgd |
|---|---|
| Name | 2-Heptene, 6-chloro-2,4,6-trimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.117528312 u |
| Formula | C10H19Cl |
| InChI | InChI=1S/C10H19Cl/c1-8(2)6-9(3)7-10(4,5)11/h6,9H,7H2,1-5H3 |
| InChIKey | AQXBQTZPWWARIL-UHFFFAOYSA-N |
| Molecular Weight | 174.715 g/mol |
| SMILES | C(=C(C)C)C(CC(Cl)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.95179 |