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S-Petasitin

View entire compound with spectra: 1 NMR

S-Petasitin
SpectraBase Compound ID GuE6N7YPcGE
InChI InChI=1S/C19H26O4S/c1-12-16(23-17(21)8-9-24-5)7-6-13-10-15(20)14(18(2,3)22)11-19(12,13)4/h8-12,16,22H,6-7H2,1-5H3/b9-8+/t12-,16+,19+/m0/s1
InChIKey SMMJMIYMTKDUOP-IYZPGKOWSA-N
Mol Weight 350.47 g/mol
Molecular Formula C19H26O4S
Exact Mass 350.15518 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G8OZD6dgtwZ
Name S-PETASITIN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H26O4S
InChI InChI=1S/C19H26O4S/c1-12-16(23-17(21)8-9-24-5)7-6-13-10-15(20)14(18(2,3)22)11-19(12,13)4/h8-12,16,22H,6-7H2,1-5H3/b9-8+/t12-,16+,19+/m0/s1
InChIKey SMMJMIYMTKDUOP-IYZPGKOWSA-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 350.473 g/mol
Solvent CDCl3
Source File Reference UWMZ520