| SpectraBase Compound ID | I1O8ACgcnsg |
|---|---|
| InChI | InChI=1S/C12H17FO/c1-12(2,3)9-14-8-10-4-6-11(13)7-5-10/h4-7H,8-9H2,1-3H3 |
| InChIKey | IODTUJJPFDTQAM-UHFFFAOYSA-N |
| Mol Weight | 196.27 g/mol |
| Molecular Formula | C12H17FO |
| Exact Mass | 196.126343 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 33Vh33TSquP |
|---|---|
| Name | (4-Fluorophenyl) methanol, neopentyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.126343329 u |
| Formula | C12H17FO |
| InChI | InChI=1S/C12H17FO/c1-12(2,3)9-14-8-10-4-6-11(13)7-5-10/h4-7H,8-9H2,1-3H3 |
| InChIKey | IODTUJJPFDTQAM-UHFFFAOYSA-N |
| Molecular Weight | 196.265 g/mol |
| SMILES | C1=CC(=CC=C1COCC(C)(C)C)F |