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7-(4-METHYLPHENYLSULFONYL)-7-AZABICYCLO-[2.2.1]-HEPTA-2,5-DIENE
SpectraBase Compound ID Ly3LRGXOWAC
InChI InChI=1S/C13H13NO2S/c1-10-2-8-13(9-3-10)17(15,16)14-11-4-5-12(14)7-6-11/h2-9,11-12H,1H3/t11-,12+
InChIKey LMGDFZBPGNBGPH-TXEJJXNPSA-N
Mol Weight 247.31 g/mol
Molecular Formula C13H13NO2S
Exact Mass 247.0667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AtELB0peVpb
Name 7-(4-METHYLPHENYLSULFONYL)-7-AZABICYCLO-[2.2.1]-HEPTA-2,5-DIENE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO2S
InChI InChI=1S/C13H13NO2S/c1-10-2-8-13(9-3-10)17(15,16)14-11-4-5-12(14)7-6-11/h2-9,11-12H,1H3/t11-,12+
InChIKey LMGDFZBPGNBGPH-TXEJJXNPSA-N
Literature Reference Author H.PRINZBACH,H.BINGMANN,H.FRITZ,J.MARKERT,L.KNOTHE,W.EBERBACH ,J.BROKATZKY-GEIGER,
Literature Reference Citation CHEM.BER.,119,616(1986)
Literature Reference DOI 10.1002/cber.19861190223
Molecular Weight 247.312 g/mol
Solvent CDCl3
Source File Reference UWGB1535