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TP-RE-(CO)-(1-METHYLIMIDAZOLE)-[2,3-ETA-(2)-[2-(4-METHOXYMETHYL-1,4-DIHYDRONAPHTHALEN-1-YL)-2-METHYLPROPIONIC-ACID-METHYLESTER]]

View entire compound with spectra: 1 NMR

TP-RE-(CO)-(1-METHYLIMIDAZOLE)-[2,3-ETA-(2)-[2-(4-METHOXYMETHYL-1,4-DIHYDRONAPHTHALEN-1-YL)-2-METHYLPROPIONIC-ACID-METHYLESTER]]
SpectraBase Compound ID KwZR3HGVftS
InChI InChI=1S/C17H20O3.C9H9BN6.C4H6N2.CO.Re/c1-17(2,16(18)20-4)15-10-9-12(11-19-3)13-7-5-6-8-14(13)15;1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;1-6-3-2-5-4-6;1-2;/h5-8,12,15H,11H2,1-4H3;1-9H;2-4H,1H3;;/t12-,15-;;;;/m1..../s1
InChIKey UNAMXOYEHWXENV-WFVKKMHQSA-N
Mol Weight 780.7 g/mol
Molecular Formula C31H35BN8O4Re
Exact Mass 781.243184 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BMTJuy41mmQ
Name TP-RE-(CO)-(1-METHYLIMIDAZOLE)-[2,3-ETA-(2)-[2-(4-METHOXYMETHYL-1,4-DIHYDRONAPHTHALEN-1-YL)-2-METHYLPROPIONIC-ACID-METHYLESTER]]
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H35BN8O4Re
InChI InChI=1S/C17H20O3.C9H9BN6.C4H6N2.CO.Re/c1-17(2,16(18)20-4)15-10-9-12(11-19-3)13-7-5-6-8-14(13)15;1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;1-6-3-2-5-4-6;1-2;/h5-8,12,15H,11H2,1-4H3;1-9H;2-4H,1H3;;/t12-,15-;;;;/m1..../s1
InChIKey UNAMXOYEHWXENV-WFVKKMHQSA-N
Literature Reference Author F.DING,M.T.VALAHOVIC,J.M.KEANE,M.R.ANSTEY,M.SABAT,C.O.TRINDL E,W.D.HARMAN
Literature Reference Citation J.ORG.CHEM.,69,2257(2004)
Literature Reference DOI 10.1021/jo030318k
Molecular Weight 780.687 g/mol
Solvent ACETONE-D6
Source File Reference UWVN21215