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Dimethyl-(2sr, 3sr,5sr,6RS)-2-phenylseleno-3-chlor-bicyclo-[2.2.2]-octan-5,6-dicarboxylate

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Dimethyl-(2sr, 3sr,5sr,6RS)-2-phenylseleno-3-chlor-bicyclo-[2.2.2]-octan-5,6-dicarboxylate
SpectraBase Compound ID 4VIdjpSZ3eN
InChI InChI=1S/C18H21ClO4Se/c1-22-17(20)13-11-8-9-12(14(13)18(21)23-2)16(15(11)19)24-10-6-4-3-5-7-10/h3-7,11-16H,8-9H2,1-2H3/t11-,12+,13-,14+,15+,16+/m1/s1
InChIKey BDBOZWZUECUHGB-IBPCWRJOSA-N
Mol Weight 415.79 g/mol
Molecular Formula C18H21ClO4Se
Exact Mass 416.029359 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IppkeSnZ4om
Name DIMETHYL-(2SR,3SR,5SR,6RS)-2-PHENYLSELENO-3-CHLOR-BICYCLO-[2.2.2]-OCTAN-5,6-DICARBOXYLATE
CAS Registry Number 72496-17-4
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21ClO4Se
InChI InChI=1S/C18H21ClO4Se/c1-22-17(20)13-11-8-9-12(14(13)18(21)23-2)16(15(11)19)24-10-6-4-3-5-7-10/h3-7,11-16H,8-9H2,1-2H3/t11-,12+,13-,14+,15+,16+/m1/s1
InChIKey BDBOZWZUECUHGB-IBPCWRJOSA-N
Literature Reference Author D.G.GARRATT,M.D.RYAN,P.L.BEAULIEU
Literature Reference Citation J.ORG.CHEM.,45,839(1980)
Literature Reference DOI 10.1021/jo01293a016
Molecular Weight 415.775 g/mol
Solvent CDCl3
Source File Reference UNIW17626