| SpectraBase Compound ID | 5T466hlbdxY |
|---|---|
| InChI | InChI=1S/C19H28O4S/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/h8-10,13,15-17,20H,1,6-7,11H2,2-5H3/b9-8+/t13-,15?,16?,17+,19+,24?/m0/s1 |
| InChIKey | OVLGYAHWOSBKJJ-PWGQHYHRSA-N |
| Mol Weight | 352.49 g/mol |
| Molecular Formula | C19H28O4S |
| Exact Mass | 352.170831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IvW2nitwOhZ |
|---|---|
| Name | PETASINOL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C19H28O4S |
| InChI | InChI=1S/C19H28O4S/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/h8-10,13,15-17,20H,1,6-7,11H2,2-5H3/b9-8+/t13-,15?,16?,17+,19+,24?/m0/s1 |
| InChIKey | OVLGYAHWOSBKJJ-PWGQHYHRSA-N |
| Literature Reference Author | Y.L.LIN,C.H.MEI,S.L.HUANG,Y.H.KUO |
| Literature Reference Citation | J.NAT.PROD.,61,887(1998) |
| Literature Reference DOI | 10.1021/np970583z |
| Molecular Weight | 352.489 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ521 |