| SpectraBase Compound ID | 6PPcNgqDJH7 |
|---|---|
| InChI | InChI=1S/C9H18O/c1-5-9(10-4)7-6-8(2)3/h5,8H,6-7H2,1-4H3/b9-5- |
| InChIKey | LUYMWCCLSQITTB-UITAMQMPSA-N |
| Mol Weight | 142.24 g/mol |
| Molecular Formula | C9H18O |
| Exact Mass | 142.135765 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GkeC3SAazIY |
|---|---|
| Name | 3-Methoxy-6-methyl-2-heptene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.135765199 u |
| Formula | C9H18O |
| InChI | InChI=1S/C9H18O/c1-5-9(10-4)7-6-8(2)3/h5,8H,6-7H2,1-4H3/b9-5- |
| InChIKey | LUYMWCCLSQITTB-UITAMQMPSA-N |
| Molecular Weight | 142.242 g/mol |
| SMILES | C\C=C\(CCC(C)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.856365 |