| SpectraBase Compound ID | InD61Du5hMV |
|---|---|
| InChI | InChI=1S/C12H18ClNO/c1-2-3-4-5-6-9-14-10-11(13)7-8-12(14)15/h7-8,10H,2-6,9H2,1H3 |
| InChIKey | DKPWVRYUVUGSFJ-UHFFFAOYSA-N |
| Mol Weight | 227.73 g/mol |
| Molecular Formula | C12H18ClNO |
| Exact Mass | 227.107692 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HWwEjhZ0VvL |
|---|---|
| Name | 1-heptyl-5-chloropyridin-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18ClNO |
| InChI | InChI=1S/C12H18ClNO/c1-2-3-4-5-6-9-14-10-11(13)7-8-12(14)15/h7-8,10H,2-6,9H2,1H3 |
| InChIKey | DKPWVRYUVUGSFJ-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 227.735 g/mol |
| SMILES | C(CCCCCC)N1C(C=CC(=C1)Cl)=O |
| SPLASH | splash10-004l-1930000000-8abee3d471cc031686f9 |
| Source of Spectrum | CN104529884A |
| Wiley ID | 1850342 |