| SpectraBase Compound ID | CYwlRk2fr6j |
|---|---|
| InChI | InChI=1S/C26H36S/c1-19(2)20-11-13-23-21(17-20)12-14-24-25(3,15-8-16-26(23,24)4)18-27-22-9-6-5-7-10-22/h5-7,9-11,17,19,23-24H,8,12-16,18H2,1-4H3/t23-,24?,25-,26+/m0/s1 |
| InChIKey | YEQOUFMKYDWVNS-QYIJMHBESA-N |
| Mol Weight | 380.6 g/mol |
| Molecular Formula | C26H36S |
| Exact Mass | 380.253772 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | jDFPE0Om0 |
|---|---|
| Name | 18-(Phenylthio)levopimaradiene |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H36S |
| InChI | InChI=1S/C26H36S/c1-19(2)20-11-13-23-21(17-20)12-14-24-25(3,15-8-16-26(23,24)4)18-27-22-9-6-5-7-10-22/h5-7,9-11,17,19,23-24H,8,12-16,18H2,1-4H3/t23-,24?,25-,26+/m0/s1 |
| InChIKey | YEQOUFMKYDWVNS-QYIJMHBESA-N |
| Molecular Weight | 380.634 g/mol |
| SMILES | [C@]12([C@@]3(C(=CC(=CC3)C(C)C)CCC1[C@@](CSc1ccccc1)(C)CCC2)[H])C |
| SPLASH | splash10-053r-1932000000-a08690ac5afb21304f51 |
| Source of Spectrum | KC-57-6163-0 |
| Wiley ID | 1625063 |