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(E)-4-(1-PENTENYL)-1,2,3,6-TETRAHYDRO-1-[(4-METHYLPHENYL)-SULFONYL]-2-PYRIDINECARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID JZ3XyqU13nq
InChI InChI=1S/C20H27NO4S/c1-4-6-7-8-17-13-14-21(19(15-17)20(22)25-5-2)26(23,24)18-11-9-16(3)10-12-18/h7-13,19H,4-6,14-15H2,1-3H3/b8-7+
InChIKey DFQLEWVSTHOVQW-BQYQJAHWSA-N
Mol Weight 377.5 g/mol
Molecular Formula C20H27NO4S
Exact Mass 377.16608 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FlmsFoKshJZ
Name (E)-4-(1-PENTENYL)-1,2,3,6-TETRAHYDRO-1-[(4-METHYLPHENYL)-SULFONYL]-2-PYRIDINECARBOXYLIC-ACID-ETHYLESTER
Compound Number 10-E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27NO4S
InChI InChI=1S/C20H27NO4S/c1-4-6-7-8-17-13-14-21(19(15-17)20(22)25-5-2)26(23,24)18-11-9-16(3)10-12-18/h7-13,19H,4-6,14-15H2,1-3H3/b8-7+
InChIKey DFQLEWVSTHOVQW-BQYQJAHWSA-N
Literature Reference Author N.CHATANI,H.INOUE,T.KOTSUMA,S.MURAI
Literature Reference Citation J.AM.CHEM.SOC.,124,10294(2002)
Literature Reference DOI 10.1021/ja0274554
Molecular Weight 377.499 g/mol
Sample ID 34765
Solvent CDCl3