| SpectraBase Compound ID | 8TyLVIDf5YH |
|---|---|
| InChI | InChI=1S/C12H16O/c1-4-12(2,3)13-10-11-8-6-5-7-9-11/h4-9H,1,10H2,2-3H3 |
| InChIKey | GGFKKRIPHPMLHF-UHFFFAOYSA-N |
| Mol Weight | 176.26 g/mol |
| Molecular Formula | C12H16O |
| Exact Mass | 176.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BSeBwn45uPV |
|---|---|
| Name | 1,1-Dimethylallyloxymethylbenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.120115134 u |
| Formula | C12H16O |
| InChI | InChI=1S/C12H16O/c1-4-12(2,3)13-10-11-8-6-5-7-9-11/h4-9H,1,10H2,2-3H3 |
| InChIKey | GGFKKRIPHPMLHF-UHFFFAOYSA-N |
| Molecular Weight | 176.259 g/mol |
| SMILES | C(C=C)(OCC=1C=CC=CC1)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.979648 |