| SpectraBase Compound ID | 9P7pv4U3Yiw |
|---|---|
| InChI | InChI=1S/C12H18O3/c1-2-3-4-5-9-15-12(14)10-7-6-8-11(10)13/h4-5,10H,2-3,6-9H2,1H3/b5-4+ |
| InChIKey | ATVWSNUOJCYPRX-SNAWJCMRSA-N |
| Mol Weight | 210.27 g/mol |
| Molecular Formula | C12H18O3 |
| Exact Mass | 210.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Aae7J1VKhVN |
|---|---|
| Name | 2-(2'-Hexenyloxycarbonyl)cyclopentanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.125594437 u |
| Formula | C12H18O3 |
| InChI | InChI=1S/C12H18O3/c1-2-3-4-5-9-15-12(14)10-7-6-8-11(10)13/h4-5,10H,2-3,6-9H2,1H3/b5-4+ |
| InChIKey | ATVWSNUOJCYPRX-SNAWJCMRSA-N |
| Molecular Weight | 210.273 g/mol |
| SMILES | C1(C(=O)OC\C=C\CCC)C(=O)CCC1 |