| SpectraBase Compound ID | Kb4ogOVGGSW |
|---|---|
| InChI | InChI=1S/C13H16O/c1-9(2)10-3-5-11(6-4-10)13(14)12-7-8-12/h3-6,9,12H,7-8H2,1-2H3 |
| InChIKey | CMKCTUAFZPHYTE-UHFFFAOYSA-N |
| Mol Weight | 188.27 g/mol |
| Molecular Formula | C13H16O |
| Exact Mass | 188.120115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KYduUocQsps |
|---|---|
| Name | Cyclopropyl p-cumenyl ketone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.120115134 u |
| Formula | C13H16O |
| InChI | InChI=1S/C13H16O/c1-9(2)10-3-5-11(6-4-10)13(14)12-7-8-12/h3-6,9,12H,7-8H2,1-2H3 |
| InChIKey | CMKCTUAFZPHYTE-UHFFFAOYSA-N |
| Molecular Weight | 188.270 g/mol |
| SMILES | C1C(C(C2=CC=C(C=C2)C(C)C)=O)C1 |