| SpectraBase Compound ID | 5Dg0fERdz3I |
|---|---|
| InChI | InChI=1S/C9H18OS/c1-4-6-7-9(8(3)10)11-5-2/h9H,4-7H2,1-3H3 |
| InChIKey | PDOXAZAKELBLPB-UHFFFAOYSA-N |
| Mol Weight | 174.3 g/mol |
| Molecular Formula | C9H18OS |
| Exact Mass | 174.107836 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4lSIaTGwS0 |
|---|---|
| Name | 3-(Ethylthio)-2-heptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18OS |
| InChI | InChI=1S/C9H18OS/c1-4-6-7-9(8(3)10)11-5-2/h9H,4-7H2,1-3H3 |
| InChIKey | PDOXAZAKELBLPB-UHFFFAOYSA-N |
| Molecular Weight | 174.302 g/mol |
| SMILES | C(=O)(C(SCC)CCCC)C |
| SPLASH | splash10-00pi-9400000000-e70aff7b7c97f71f8a92 |
| Source of Spectrum | F-56-6544-2 |
| Synonyms | 3-(ethylsulfanyl)-2-heptanone |
| Wiley ID | 858245 |