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CIS-4,5-DIHYDRO-1-(4'-METHYLPHENYLSULFONYL)-2,4,5-TRIMETHYLCYCLOPENTA-[B]-PYRROL-6(1H)-ONE
SpectraBase Compound ID Lr2n7jryq4N
InChI InChI=1S/C17H19NO3S/c1-10-5-7-14(8-6-10)22(20,21)18-11(2)9-15-12(3)13(4)17(19)16(15)18/h5-9,12-13H,1-4H3/t12-,13+/m0/s1
InChIKey VLHKJWOJQBGFAX-QWHCGFSZSA-N
Mol Weight 317.4 g/mol
Molecular Formula C17H19NO3S
Exact Mass 317.108565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4H1tpv6B5F9
Name CIS-4,5-DIHYDRO-1-(4'-METHYLPHENYLSULFONYL)-2,4,5-TRIMETHYLCYCLOPENTA-[B]-PYRROL-6(1H)-ONE
Compound Number 24A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H19NO3S
InChI InChI=1S/C17H19NO3S/c1-10-5-7-14(8-6-10)22(20,21)18-11(2)9-15-12(3)13(4)17(19)16(15)18/h5-9,12-13H,1-4H3/t12-,13+/m0/s1
InChIKey VLHKJWOJQBGFAX-QWHCGFSZSA-N
Literature Reference Author C.SONG,D.W.KNIGHT,M.A.WHATTON
Literature Reference Citation ORG.LETTERS,8,163(2006)
Literature Reference DOI 10.1021/ol052683z
Molecular Weight 317.403 g/mol
Sample ID 39847
Solvent CDCl3