| SpectraBase Compound ID | 3Gptp9xtCYC |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-3-7-12(14-10(2)13)11-8-5-4-6-9-11/h3-9,12H,1-2H3/b7-3- |
| InChIKey | REKUSVUEERORCK-CLTKARDFSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68wsrY85IuM |
|---|---|
| Name | (Z)-1-Phenylbut-2-enyl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-3-7-12(14-10(2)13)11-8-5-4-6-9-11/h3-9,12H,1-2H3/b7-3- |
| InChIKey | REKUSVUEERORCK-CLTKARDFSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C(OC(\C=C/C)C=1C=CC=CC1)(=O)C |