| SpectraBase Compound ID | 3R1I7sd9xDu |
|---|---|
| InChI | InChI=1S/C11H15FO/c1-11(2,3)9-7-8(12)5-6-10(9)13-4/h5-7H,1-4H3 |
| InChIKey | NTPIQAPSLHBHDZ-UHFFFAOYSA-N |
| Mol Weight | 182.24 g/mol |
| Molecular Formula | C11H15FO |
| Exact Mass | 182.110693 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1MOk3Dy8hE9 |
|---|---|
| Name | 2-Tert-butyl-4-fluoroanisole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.110693265 u |
| Formula | C11H15FO |
| InChI | InChI=1S/C11H15FO/c1-11(2,3)9-7-8(12)5-6-10(9)13-4/h5-7H,1-4H3 |
| InChIKey | NTPIQAPSLHBHDZ-UHFFFAOYSA-N |
| Molecular Weight | 182.238 g/mol |
| SMILES | C1=C(C(=CC(=C1)F)C(C)(C)C)OC |
| Spectrum/Structure Validation Score (Raman) | 0.705612 |