| SpectraBase Compound ID | 8jGwh4bQKm1 |
|---|---|
| InChI | InChI=1S/C5H10OS/c6-7-4-2-1-3-5-7/h1-5H2/i2D2,4D2 |
| InChIKey | NNLBRYQGMOYARS-BYUTVXSXSA-N |
| Mol Weight | 122.22 g/mol |
| Molecular Formula | C5H6D4OS |
| Exact Mass | 122.070343 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CaERFId7o |
|---|---|
| Name | Pentamethylene sulfoxide-D4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H6D4OS |
| InChI | InChI=1S/C5H10OS/c6-7-4-2-1-3-5-7/h1-5H2/i2D2,4D2 |
| InChIKey | NNLBRYQGMOYARS-BYUTVXSXSA-N |
| Molecular Weight | 122.218 g/mol |
| SMILES | C1(S(=O)CCCC1([D])[D])([D])[D] |
| SPLASH | splash10-0229-9200000000-19ba14f8ea1343872876 |
| Source of Spectrum | AJ-45-1769-9 |
| Wiley ID | 1126343 |