| SpectraBase Compound ID | LPeZ1rFwbR4 |
|---|---|
| InChI | InChI=1S/C18H36O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(19)17-21(2)20/h3-17H2,1-2H3 |
| InChIKey | PIQBYTSUTNJLDR-UHFFFAOYSA-N |
| Mol Weight | 316.5 g/mol |
| Molecular Formula | C18H36O2S |
| Exact Mass | 316.243602 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4Hi4Al1Eh9N |
|---|---|
| Name | 1-Methylsulfinylheptadecan-2-one |
| CAS Registry Number | 51840-11-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H36O2S |
| InChI | InChI=1S/C18H36O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(19)17-21(2)20/h3-17H2,1-2H3 |
| InChIKey | PIQBYTSUTNJLDR-UHFFFAOYSA-N |
| Molecular Weight | 316.544 g/mol |
| SMILES | C(S(=O)C)C(=O)CCCCCCCCCCCCCCC |
| SPLASH | splash10-0595-9120000000-3870c54d9727194858b5 |
| Source of Spectrum | J-54-5622-1 |
| Wiley ID | 1316871 |