| SpectraBase Compound ID | CCfmQbzy8Y2 |
|---|---|
| InChI | InChI=1S/C14H14O2/c15-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-14/h1-3,6-7,12H,4-5,8-9H2 |
| InChIKey | IIZJBJCDVJXOIU-UHFFFAOYSA-N |
| Mol Weight | 214.26 g/mol |
| Molecular Formula | C14H14O2 |
| Exact Mass | 214.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JClzsy2REj2 |
|---|---|
| Name | 3-Phenyl-5,6,7,7A-tetrahydro-4H-1-benzofuran-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.099379689 u |
| Formula | C14H14O2 |
| InChI | InChI=1S/C14H14O2/c15-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-14/h1-3,6-7,12H,4-5,8-9H2 |
| InChIKey | IIZJBJCDVJXOIU-UHFFFAOYSA-N |
| Molecular Weight | 214.264 g/mol |
| SMILES | C1(C(=C2CCCCC2O1)C=1C=CC=CC1)=O |