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(1R,2S,7AS)-1-ETHENYL-2-(2-BROMO-3-METHYLPHENOXY)-PYRROLIZIDIN-3-ONE
SpectraBase Compound ID JrxXyVZbUcU
InChI InChI=1S/C16H18BrNO2/c1-3-11-12-7-5-9-18(12)16(19)15(11)20-13-8-4-6-10(2)14(13)17/h3-4,6,8,11-12,15H,1,5,7,9H2,2H3/t11-,12+,15+/m1/s1
InChIKey QKVQLSAAFOULLV-XUJVJEKNSA-N
Mol Weight 336.23 g/mol
Molecular Formula C16H18BrNO2
Exact Mass 335.052092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4rMbC8avxad
Name (1R,2S,7AS)-1-ETHENYL-2-(2-BROMO-3-METHYLPHENOXY)-PYRROLIZIDIN-3-ONE
Compound Number 9D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18BrNO2
InChI InChI=1S/C16H18BrNO2/c1-3-11-12-7-5-9-18(12)16(19)15(11)20-13-8-4-6-10(2)14(13)17/h3-4,6,8,11-12,15H,1,5,7,9H2,2H3/t11-,12+,15+/m1/s1
InChIKey QKVQLSAAFOULLV-XUJVJEKNSA-N
Literature Reference Author C.HEESCHER,D.SCHOLLMEYER,U.NUBBLMEYER
Literature Reference Citation EUR.J.ORG.CHEM.,2013,4399(2013)
Literature Reference DOI 10.1002/ejoc.201300389
Molecular Weight 336.228 g/mol
Solvent CDCl3
Source File Reference UWBT18232