| SpectraBase Compound ID | BgEBun4EE7S |
|---|---|
| InChI | InChI=1S/C11H16O2/c1-8(2)11(12)9-4-6-10(13-3)7-5-9/h4-8,11-12H,1-3H3 |
| InChIKey | BFMJGRZIBITFRD-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 | 51IWzeo7j8J |
|---|---|
| Name | 1-(4'-Methoxyphenyl)-2-methylpropan-1-ol |
| 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/c1-8(2)11(12)9-4-6-10(13-3)7-5-9/h4-8,11-12H,1-3H3 |
| InChIKey | BFMJGRZIBITFRD-UHFFFAOYSA-N |
| Molecular Weight | 180.247 g/mol |
| SMILES | C(O)(C1=CC=C(C=C1)OC)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.929221 |