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(-)-6-BETA-CINNAMOYLOXYTROPAN-3-ALPHA-METHYLMESACONATE
SpectraBase Compound ID Eekac3NQmFx
InChI InChI=1S/C23H27NO6/c1-15(23(27)28-3)11-22(26)29-18-12-17-13-20(19(14-18)24(17)2)30-21(25)10-9-16-7-5-4-6-8-16/h4-11,17-20H,12-14H2,1-3H3/b10-9+,15-11+/t17-,18-,19-,20-/m1/s1
InChIKey DFGZBHQWARLLMF-XNKLZHFQSA-N
Mol Weight 413.47 g/mol
Molecular Formula C23H27NO6
Exact Mass 413.183838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CCXzJlfC128
Name (-)-6-BETA-CINNAMOYLOXYTROPAN-3-ALPHA-METHYLMESACONATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27NO6
InChI InChI=1S/C23H27NO6/c1-15(23(27)28-3)11-22(26)29-18-12-17-13-20(19(14-18)24(17)2)30-21(25)10-9-16-7-5-4-6-8-16/h4-11,17-20H,12-14H2,1-3H3/b10-9+,15-11+/t17-,18-,19-,20-/m1/s1
InChIKey DFGZBHQWARLLMF-XNKLZHFQSA-N
Literature Reference Author O.MUNOZ,M.PIOVANO,J.GARBARINO,V.HELLWING,E.BREITMAIER
Literature Reference Citation PHYTOCHEM.,43,709(1996)
Literature Reference DOI 10.1016/0031-9422(96)00308-1
Molecular Weight 413.470 g/mol
Solvent Unknown
Source File Reference UWMS2155