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CYLINDRICINE-F;REL-(3R,4R,5S,7AR,11AR)-5-HEXYL-3-THIOCYANATOMETHYLPERHYDROPYRROLO-[2,1-J]-QUINOLIN-7-ONE
SpectraBase Compound ID 3lFdrQiaIZ6
InChI InChI=1S/C20H32N2OS/c1-2-3-4-5-8-16-13-19(23)18-9-6-7-11-20(18)12-10-17(22(16)20)14-24-15-21/h16-18H,2-14H2,1H3/t16-,17+,18?,20+/m1/s1
InChIKey QWOZNKGCXULCKK-DESAJYIVSA-N
Mol Weight 348.5 g/mol
Molecular Formula C20H32N2OS
Exact Mass 348.223535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ELAAtN06E9L
Name CYLINDRICINE-F;REL-(3R,4R,5S,7AR,11AR)-5-HEXYL-3-THIOCYANATOMETHYLPERHYDROPYRROLO-[2,1-J]-QUINOLIN-7-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32N2OS
InChI InChI=1S/C20H32N2OS/c1-2-3-4-5-8-16-13-19(23)18-9-6-7-11-20(18)12-10-17(22(16)20)14-24-15-21/h16-18H,2-14H2,1H3/t16-,17+,18?,20+/m1/s1
InChIKey QWOZNKGCXULCKK-DESAJYIVSA-N
Literature Reference Author C.LI,A.J.BLACKMAN
Literature Reference Citation AUSTR.J.CHEM.,47,1355(1994)
Literature Reference DOI 10.1071/ch9941355
Molecular Weight 348.547 g/mol
Solvent CDCl3
Source File Reference UWVP5181