| SpectraBase Compound ID | 7xImTznZqLb |
|---|---|
| InChI | InChI=1S/C9H12OS/c1-7(5-8(2)10)9-3-4-11-6-9/h3-4,6-7H,5H2,1-2H3 |
| InChIKey | BRNLCQSSITZYIT-UHFFFAOYSA-N |
| Mol Weight | 168.25 g/mol |
| Molecular Formula | C9H12OS |
| Exact Mass | 168.060886 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2FkfVXGWcKJ |
|---|---|
| Name | 4-(3-Thienyl)-2-pentanone |
| Alternate Name(s) | 4-(3-Thiophenyl)-2-pentanone 4-Thiophen-3-ylpentan-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12OS |
| InChI | InChI=1S/C9H12OS/c1-7(5-8(2)10)9-3-4-11-6-9/h3-4,6-7H,5H2,1-2H3 |
| InChIKey | BRNLCQSSITZYIT-UHFFFAOYSA-N |
| Molecular Weight | 168.254 g/mol |
| SMILES | c1(cscc1)C(CC(=O)C)C |
| SPLASH | splash10-02dj-1900000000-daa86bddc1de5c18e10f |
| Source of Spectrum | F-35-336-0 |
| Wiley ID | 1164239 |