| SpectraBase Compound ID | 1tkTCwdydDN |
|---|---|
| InChI | InChI=1S/C13H24O/c1-4-7-9-11-13(14)12(6-3)10-8-5-2/h4,7,12H,5-6,8-11H2,1-3H3/b7-4+ |
| InChIKey | ZBLYGRYROINQDI-QPJJXVBHSA-N |
| Mol Weight | 196.33 g/mol |
| Molecular Formula | C13H24O |
| Exact Mass | 196.182715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CixBpb5wKuO |
|---|---|
| Name | 7-Ethyl-2-undecen-6-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.182715392 u |
| Formula | C13H24O |
| InChI | InChI=1S/C13H24O/c1-4-7-9-11-13(14)12(6-3)10-8-5-2/h4,7,12H,5-6,8-11H2,1-3H3/b7-4+ |
| InChIKey | ZBLYGRYROINQDI-QPJJXVBHSA-N |
| Molecular Weight | 196.334 g/mol |
| SMILES | C(C(C(CCCC)CC)=O)C\C=C\C |