| SpectraBase Compound ID | 2kisPHCPRrc |
|---|---|
| InChI | InChI=1S/C19H26O4S/c1-12(2)15-11-19(4)13(3)17(7-6-14(19)10-16(15)20)23-18(21)8-9-24(5)22/h8-10,13,15,17H,1,6-7,11H2,2-5H3/b9-8-/t13-,15-,17+,19+,24?/m0/s1 |
| InChIKey | PUIKQNUXMJPABH-XEJPENRXSA-N |
| Mol Weight | 350.47 g/mol |
| Molecular Formula | C19H26O4S |
| Exact Mass | 350.15518 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IVa6KXjxvky |
|---|---|
| Name | EREMOPETASINSULPHOXIDE;MAJOR-ISOMER |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C19H26O4S |
| InChI | InChI=1S/C19H26O4S/c1-12(2)15-11-19(4)13(3)17(7-6-14(19)10-16(15)20)23-18(21)8-9-24(5)22/h8-10,13,15,17H,1,6-7,11H2,2-5H3/b9-8-/t13-,15-,17+,19+,24?/m0/s1 |
| InChIKey | PUIKQNUXMJPABH-XEJPENRXSA-N |
| Literature Reference Author | M.TORI,M.KAWAHARA,M.SONO |
| Literature Reference Citation | PHYTOCHEM.,47,401(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00581-5 |
| Molecular Weight | 350.473 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS151 |