| SpectraBase Compound ID | 4sz2KUIsUgW |
|---|---|
| InChI | InChI=1S/C13H16O2/c1-9(2)11-8-12(14)15-13(11)10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3/t11-,13+/m0/s1 |
| InChIKey | KNRZXACLGUWLOW-WCQYABFASA-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 | 7beGNoj6dd0 |
|---|---|
| Name | (4S*,5S*)-cis-(+-)-4-isopropyl-5-phenyltetrahydrofuran-2-one |
| 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/c1-9(2)11-8-12(14)15-13(11)10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3/t11-,13+/m0/s1 |
| InChIKey | KNRZXACLGUWLOW-WCQYABFASA-N |
| Molecular Weight | 204.269 g/mol |
| SMILES | [C@]1(OC(=O)C[C@]1(C(C)C)[H])(C1=CC=CC=C1)[H] |