| SpectraBase Compound ID | GddZTbnRyXc |
|---|---|
| InChI | InChI=1S/C13H16O2/c1-11(2)8-9-15-10-13(14)12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3 |
| InChIKey | MXMQIRYBCYFUOK-UHFFFAOYSA-N |
| Mol Weight | 204.27 g/mol |
| Molecular Formula | C13H16O2 |
| Exact Mass | 204.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K05qAxmbGeJ |
|---|---|
| Name | 2-(3-Methylbut-2-enoxy)-1-phenyl-ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.115029753 u |
| Formula | C13H16O2 |
| InChI | InChI=1S/C13H16O2/c1-11(2)8-9-15-10-13(14)12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3 |
| InChIKey | MXMQIRYBCYFUOK-UHFFFAOYSA-N |
| Molecular Weight | 204.269 g/mol |
| SMILES | C(=O)(C1=CC=CC=C1)COCC=C(C)C |