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(E)-N'-[3-{4-[(E)-3,7-DIMETHYLOCTA-2,6-DIENYLOXY]-PHENYL}-PROPENOYL]-ISONICOTINOHYDRAZIDE
SpectraBase Compound ID 7hkt9YVAE3J
InChI InChI=1S/C25H29N3O3/c1-19(2)5-4-6-20(3)15-18-31-23-10-7-21(8-11-23)9-12-24(29)27-28-25(30)22-13-16-26-17-14-22/h5,7-17H,4,6,18H2,1-3H3,(H,27,29)(H,28,30)/b12-9+,20-15+
InChIKey LKXJZLZVZJVMMK-NSWHACQGSA-N
Mol Weight 419.53 g/mol
Molecular Formula C25H29N3O3
Exact Mass 419.220892 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KKdXMxnmWVA
Name (E)-N'-[3-{4-[(E)-3,7-DIMETHYLOCTA-2,6-DIENYLOXY]-PHENYL}-PROPENOYL]-ISONICOTINOHYDRAZIDE
Compound Number 11F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H29N3O3
InChI InChI=1S/C25H29N3O3/c1-19(2)5-4-6-20(3)15-18-31-23-10-7-21(8-11-23)9-12-24(29)27-28-25(30)22-13-16-26-17-14-22/h5,7-17H,4,6,18H2,1-3H3,(H,27,29)(H,28,30)/b12-9+,20-15+
InChIKey LKXJZLZVZJVMMK-NSWHACQGSA-N
Literature Reference Author P.DE,G.K.YOYA,P.CONSTANT,F.BEDOS-BELVAL,H.DURAN,N.SAFFON,M.D AFFE,M.BALTAS
Literature Reference Citation J.MED.CHEM.,54,1449(2011)
Literature Reference DOI 10.1021/jm101510d
Molecular Weight 419.524 g/mol
Solvent CDCl3
Source File Reference UWMZ48155