| SpectraBase Compound ID | Dj5MBgxO0s4 |
|---|---|
| InChI | InChI=1S/C13H16O2/c14-13(12-8-9-12)15-10-4-7-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2 |
| InChIKey | SCFCHTOLDOZIRC-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 | 9jj5CQnr744 |
|---|---|
| Name | Cyclopropanecarboxylic acid, 3-phenylpropyl ester |
| 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/c14-13(12-8-9-12)15-10-4-7-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2 |
| InChIKey | SCFCHTOLDOZIRC-UHFFFAOYSA-N |
| Molecular Weight | 204.269 g/mol |
| SMILES | C1=C(C=CC=C1)CCCOC(C1CC1)=O |