| SpectraBase Compound ID | Ls8Be0EwEky |
|---|---|
| InChI | InChI=1S/C11H21Cl/c1-9(2)7-10(3,4)8-11(5,6)12/h7H,8H2,1-6H3 |
| InChIKey | INIIOTVHSABYKV-UHFFFAOYSA-N |
| Mol Weight | 188.74 g/mol |
| Molecular Formula | C11H21Cl |
| Exact Mass | 188.133178 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8TFfGUeKdzd |
|---|---|
| Name | 2-Heptene, 6-chloro-2,4,4,6-tetramethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.133178376 u |
| Formula | C11H21Cl |
| InChI | InChI=1S/C11H21Cl/c1-9(2)7-10(3,4)8-11(5,6)12/h7H,8H2,1-6H3 |
| InChIKey | INIIOTVHSABYKV-UHFFFAOYSA-N |
| Molecular Weight | 188.742 g/mol |
| SMILES | C(C(CC(Cl)(C)C)(C)C)=C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937867 |