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NEO-S-PETASIN
SpectraBase Compound ID EZkdphY71zP
InChI InChI=1S/C19H26O3S/c1-12(2)15-11-19(4)13(3)17(22-18(21)8-9-23-5)7-6-14(19)10-16(15)20/h8-10,13,15,17H,1,6-7,11H2,2-5H3/b9-8-/t13-,15+,17+,19+/m0/s1
InChIKey OHANKWLYFDFHOJ-OXRZYUPZSA-N
Mol Weight 334.47 g/mol
Molecular Formula C19H26O3S
Exact Mass 334.160266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID VaQtlpFYrr
Name NEO-S-PETASIN
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H26O3S
InChI InChI=1S/C19H26O3S/c1-12(2)15-11-19(4)13(3)17(22-18(21)8-9-23-5)7-6-14(19)10-16(15)20/h8-10,13,15,17H,1,6-7,11H2,2-5H3/b9-8-/t13-,15+,17+,19+/m0/s1
InChIKey OHANKWLYFDFHOJ-OXRZYUPZSA-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 334.474 g/mol
Solvent CDCl3
Source File Reference UWMS155