| SpectraBase Compound ID | LiMxeivibMZ |
|---|---|
| InChI | InChI=1S/C15H22O/c1-4-5-6-7-8-14(3)16-15-11-9-13(2)10-12-15/h9-12H,3-8H2,1-2H3 |
| InChIKey | RQBLTGWMDSHJPZ-UHFFFAOYSA-N |
| Mol Weight | 218.34 g/mol |
| Molecular Formula | C15H22O |
| Exact Mass | 218.167065 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 17GYwqZAiSn |
|---|---|
| Name | 1-Methyl-4-(1-methyleneheptoxy)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.167065327 u |
| Formula | C15H22O |
| InChI | InChI=1S/C15H22O/c1-4-5-6-7-8-14(3)16-15-11-9-13(2)10-12-15/h9-12H,3-8H2,1-2H3 |
| InChIKey | RQBLTGWMDSHJPZ-UHFFFAOYSA-N |
| Molecular Weight | 218.340 g/mol |
| SMILES | C(OC=1C=CC(=CC1)C)(=C)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.85657 |