| SpectraBase Compound ID | 1J2NvHdrsXl |
|---|---|
| InChI | InChI=1S/C13H18OS/c1-3-4-8-12(2)15(14)11-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11H2,1H3/i2D/b12-2- |
| InChIKey | MPQMVFDRQKQZJD-GDZIECTRSA-N |
| Mol Weight | 223.35 g/mol |
| Molecular Formula | C13H172DOS |
| Exact Mass | 223.114113 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6TM0DYbQZJu |
|---|---|
| Name | Benzyl (Z)-1-Deuterio-2-hex-1-enyl sulfoxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H17DOS |
| InChI | InChI=1S/C13H18OS/c1-3-4-8-12(2)15(14)11-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11H2,1H3/i2D/b12-2- |
| InChIKey | MPQMVFDRQKQZJD-GDZIECTRSA-N |
| Molecular Weight | 223.352 g/mol |
| SMILES | C(\C(S(=O)Cc1ccccc1)=C\[2D])CCC |
| SPLASH | splash10-0006-9100000000-7997f5448b0bbfc0cc8a |
| Source of Spectrum | C-117-191-20 |
| Wiley ID | 758614 |