| SpectraBase Compound ID | 7y6TTTYDMYJ |
|---|---|
| InChI | InChI=1S/C8H12O/c1-4-6-8(5-2)7-9-3/h4H,1-2,6-7H2,3H3 |
| InChIKey | IXMBGIULMAIQJW-UHFFFAOYSA-N |
| Mol Weight | 124.18 g/mol |
| Molecular Formula | C8H12O |
| Exact Mass | 124.088815 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8aboxHjBw5J |
|---|---|
| Name | 3-(Methoxymethyl)hexa-1,3,5-triene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 124.088815005 u |
| Formula | C8H12O |
| InChI | InChI=1S/C8H12O/c1-4-6-8(5-2)7-9-3/h4H,1-2,6-7H2,3H3 |
| InChIKey | IXMBGIULMAIQJW-UHFFFAOYSA-N |
| Molecular Weight | 124.183 g/mol |
| SMILES | C(=C=C)(CC=C)COC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.872882 |