| SpectraBase Compound ID | KQfuxZA7p6o |
|---|---|
| InChI | InChI=1S/C11H14O2/c1-9(8-12)7-11(13)10-5-3-2-4-6-10/h2-7,11-13H,8H2,1H3/b9-7- |
| InChIKey | OJDOTJHILUEASW-CLFYSBASSA-N |
| Mol Weight | 178.23 g/mol |
| Molecular Formula | C11H14O2 |
| Exact Mass | 178.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Mo0JapzBCK |
|---|---|
| Name | (Z)-3-Methyl-1-phenyl-2-butene-1,4-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.099379689 u |
| Formula | C11H14O2 |
| InChI | InChI=1S/C11H14O2/c1-9(8-12)7-11(13)10-5-3-2-4-6-10/h2-7,11-13H,8H2,1H3/b9-7- |
| InChIKey | OJDOTJHILUEASW-CLFYSBASSA-N |
| Molecular Weight | 178.231 g/mol |
| SMILES | C(\C=C/(CO)C)(C1=CC=CC=C1)O |