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SODIUM-8-HYDROXY-8-(2-PENTYLOXYPYRIDIN-3-YL)-OCT-5-YNOATE

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SODIUM-8-HYDROXY-8-(2-PENTYLOXYPYRIDIN-3-YL)-OCT-5-YNOATE
SpectraBase Compound ID BSIYkU2lOg7
InChI InChI=1S/C18H25NO4.Na/c1-2-3-8-14-23-18-15(10-9-13-19-18)16(20)11-6-4-5-7-12-17(21)22;/h9-10,13,16,20H,2-3,5,7-8,11-12,14H2,1H3,(H,21,22);/q;+1/p-1
InChIKey GEQPYYBTCJVBRL-UHFFFAOYSA-M
Mol Weight 341.38 g/mol
Molecular Formula C18H24NNaO4
Exact Mass 341.160303 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iv5OaqMhZzL
Name SODIUM-8-HYDROXY-8-(2-PENTYLOXYPYRIDIN-3-YL)-OCT-5-YNOATE
Compound Number 48
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H24NNaO4
InChI InChI=1S/C18H25NO4.Na/c1-2-3-8-14-23-18-15(10-9-13-19-18)16(20)11-6-4-5-7-12-17(21)22;/h9-10,13,16,20H,2-3,5,7-8,11-12,14H2,1H3,(H,21,22);/q;+1/p-1
InChIKey GEQPYYBTCJVBRL-UHFFFAOYSA-M
Literature Reference Author F.CAIJO,P.MOSSET,R.GREE,V.AUDINOT-BOUCHEZ,J.BOUTIN,P.RENARD, D.H.CAIGNARD,C.DACQU
Literature Reference Citation EUR.J.ORG.CHEM.,2181(2006)
Literature Reference DOI 10.1002/ejoc.200500918
Molecular Weight 341.383 g/mol
Sample ID 46634
Solvent DMSO