| SpectraBase Compound ID | FQQv2MZUSTN |
|---|---|
| InChI | InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H |
| InChIKey | ISWSIDIOOBJBQZ-UHFFFAOYSA-N |
| Mol Weight | 94.11 g/mol |
| Molecular Formula | C6H6O |
| Exact Mass | 94.041865 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FxYsJk5Drxb |
|---|---|
| Name | Phenol |
| CAS Registry Number | 108-95-2 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H6O |
| InChI | InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H |
| InChIKey | ISWSIDIOOBJBQZ-UHFFFAOYSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | J. Org. Chem. 44, 1183 (1979). |
| NMR Standard | not reported |
| Observed nucleus | 17O |
| Solvent | Neat liquid |