| SpectraBase Compound ID | 5xMnrzTzI91 |
|---|---|
| InChI | InChI=1S/C11H16O2/c1-9-4-3-5-11(6-9)8-13-10(2)7-12/h3-6,10,12H,7-8H2,1-2H3 |
| InChIKey | HYXUGXHKTHPNRW-UHFFFAOYSA-N |
| Mol Weight | 180.25 g/mol |
| Molecular Formula | C11H16O2 |
| Exact Mass | 180.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Cx1YFTteeMp |
|---|---|
| Name | 3-Methylbenzyl(1-hydroxyprop-2-yl)ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.115029753 u |
| Formula | C11H16O2 |
| InChI | InChI=1S/C11H16O2/c1-9-4-3-5-11(6-9)8-13-10(2)7-12/h3-6,10,12H,7-8H2,1-2H3 |
| InChIKey | HYXUGXHKTHPNRW-UHFFFAOYSA-N |
| Molecular Weight | 180.247 g/mol |
| SMILES | C1(=CC=CC(=C1)COC(C)CO)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.876816 |