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TERT.-BUTYL-(2S)-2-[(7A-S)-2-(6H)-OXO-7,7A-DIHYDRO-6-BROMO-7A-BENZOFURANYL]-TETRAHYDROPYRROLE-1-CARBOXYLATE;FIRST-ELUTED-ISOMER

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TERT.-BUTYL-(2S)-2-[(7A-S)-2-(6H)-OXO-7,7A-DIHYDRO-6-BROMO-7A-BENZOFURANYL]-TETRAHYDROPYRROLE-1-CARBOXYLATE;FIRST-ELUTED-ISOMER
SpectraBase Compound ID 2CT9KcOZDJr
InChI InChI=1S/C17H22BrNO4/c1-16(2,3)23-15(21)19-8-4-5-13(19)17-10-12(18)7-6-11(17)9-14(20)22-17/h6-7,9,12-13H,4-5,8,10H2,1-3H3/t12?,13-,17+/m0/s1
InChIKey DKIFXSYLPDTMJJ-PMBLOPFUSA-N
Mol Weight 384.27 g/mol
Molecular Formula C17H22BrNO4
Exact Mass 383.073221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JrnBNKHGs5W
Name TERT.-BUTYL-(2S)-2-[(7A-S)-2-(6H)-OXO-7,7A-DIHYDRO-6-BROMO-7A-BENZOFURANYL]-TETRAHYDROPYRROLE-1-CARBOXYLATE;FIRST-ELUTED-ISOMER
Compound Number 6-BR
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22BrNO4
InChI InChI=1S/C17H22BrNO4/c1-16(2,3)23-15(21)19-8-4-5-13(19)17-10-12(18)7-6-11(17)9-14(20)22-17/h6-7,9,12-13H,4-5,8,10H2,1-3H3/t12?,13-,17+/m0/s1
InChIKey DKIFXSYLPDTMJJ-PMBLOPFUSA-N
Literature Reference Author R.ALIBES,M.BALLBE,F.BUSQUE,P.D.MARCH,L.ELIAS,M.FIGUEREDO,J.F ONT
Literature Reference Citation ORG.LETTERS,6,1813(2004)
Literature Reference DOI 10.1021/ol049455+
Molecular Weight 384.270 g/mol
Sample ID 38740
Solvent CDCl3