Semi-real-time pure shift NMR spectroscopy

    Dataset

    Description

    Pulse sequence code, macros, and example data for 1D band-selective semi-real-time pure shift NMR experiments

    Peter Kiraly, Mathias Nilsson, Gareth A. Morris
    NMR Methodology Group
    University of Manchester
    Nov 2017
    =============================================================================================================
    Experimental data [\data]

    \data\Fig-3
    Sample details: 5mM cyclosporine in CD2Cl2

    a.fid conventional proton experiment
    b.fid time-shared homodecoupling
    c/d/e/f_raw-data.fid raw data of interferogram/real time/WATERGATE-semi-real-time/semi-real-time experiments
    c/d/e/f_proc-data.fid processed data of interferogram/real time/WATERGATE-semi-real-time/semi-real-time experiments

    \data\Fig-4
    Sample details: 0.05mM cyclosporine in CD2Cl2

    a.fid conventional proton experiment
    b.fid time-shared homodecoupling
    c/d/e/f_raw-data.fid raw data of interferogram/real time/WATERGATE-semi-real-time/semi-real-time experiments
    c/d/e/f_proc-data.fid processed data of interferogram/real time/WATERGATE-semi-real-time/semi-real-time experiments
    Left and Right in filenames refers to the selected NH and CH region

    \data\Fig-5
    Sample details: 0.58M 2,3-dibromothiophene in dmso-d6 (doped with chromium-acetylacetonate)

    a.fid conventional proton experiment
    b.fid time-shared homodecoupling without BS compensation
    c.fid time-shared homodecoupling with BS compensation
    d/e/f/g_raw-data.fid raw data of interferogram/real time/WATERGATE-semi-real-time/semi-real-time experiments
    d/e/f/g_proc-data.fid processed data of interferogram/real time/WATERGATE-semi-real-time/semi-real-time experiments


    \data\Fig-6
    Sample details: 5mM cyclosporine in CD2Cl2


    a.fid time-shared homodecoupling
    b.fid 1D band-selective TOCSY
    c.fid 1D sleective DQF-COSY
    d.fid conventional proton

    \data\Fig-7
    Sample details: 2.5mM mixture of R/S-ibuprofen and 10mM beta-cyclodextrin in D2O

    a.fid conventional proton experiment
    b.fid time-shared homodecoupling using 10Hz SEDUCE-2
    c.fid time-shared homodecoupling using 25Hz DSNOB
    d/e/f/g_raw-data.fid raw data of interferogram/real time/WATERGATE-semi-real-time/semi-real-time experiments
    d/e/f/g_proc-data.fid processed data of interferogram/real time/WATERGATE-semi-real-time/semi-real-time experiments


    =============================================================================================================
    Macro files [\maclib]

    go_kp_ifPSZS_1d_01
    go_kp_rtPSZS_1d_02
    go_kp_srtPSZS_1d_02
    kp_ifZSproc2
    kp_makePS7
    kp_makePS9
    kp_rtACQ31_proc_v3
    kp_srtACQ31_proc_v6
    =============================================================================================================
    Pulse sequence files [\psglib]

    kp_ifPSZS_1d_01.c
    kp_rtPSZS_1d_02.c
    kp_srtPSZS_1d_02.c
    =============================================================================================================
    Date made available26 Apr 2018
    PublisherMendeley Data

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