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BAClINIC-ACID
SpectraBase Compound ID ALCBh0N0k1E
InChI InChI=1S/C20H32O5/c1-14-10-19(2)11-16(18(24)25)4-3-5-17(19)20(14,13-23)8-6-15(12-22)7-9-21/h4,7,14,17,21-23H,3,5-6,8-13H2,1-2H3,(H,24,25)/b15-7-/t14-,17+,19-,20-/m1/s1
InChIKey JCWINCIZDNXUMA-SPQHETMKSA-N
Mol Weight 352.5 g/mol
Molecular Formula C20H32O5
Exact Mass 352.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 64XwDSRJhiX
Name BAClINIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O5
InChI InChI=1S/C20H32O5/c1-14-10-19(2)11-16(18(24)25)4-3-5-17(19)20(14,13-23)8-6-15(12-22)7-9-21/h4,7,14,17,21-23H,3,5-6,8-13H2,1-2H3,(H,24,25)/b15-7-/t14-,17+,19-,20-/m1/s1
InChIKey JCWINCIZDNXUMA-SPQHETMKSA-N
Literature Reference Author K.HE,G.MONTENEGRO,J.J.HOFFMANN,B.N.TIMMERMANN
Literature Reference Citation PHYTOCHEM.,41,1123(1996)
Literature Reference DOI 10.1016/0031-9422(95)00780-6
Molecular Weight 352.471 g/mol
Solvent DMSO
Source File Reference UWLU4256