######################### # Spectral peak lists # ######################### save_spectral_peaks_1D_1H _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peaks_1D_1H _Spectral_peak_list.Entry_ID bmse011185 _Spectral_peak_list.ID 1 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 1 _Spectral_peak_list.Experiment_name '1D 1H' _Spectral_peak_list.Number_of_spectral_dimensions 1 _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Details 'F1: 1H' loop_ _Spectral_dim.ID _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 600.1728185 H 1 'Full H' 12.0157698570257 ppm bmse011185 1 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $software_topspin bmse011185 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011185 1 2 bmse011185 1 3 bmse011185 1 4 bmse011185 1 5 bmse011185 1 6 bmse011185 1 7 bmse011185 1 8 bmse011185 1 9 bmse011185 1 10 bmse011185 1 12 bmse011185 1 13 bmse011185 1 14 bmse011185 1 stop_ loop_ _Peak_char.Peak_ID _Peak_char.Spectral_dim_ID _Peak_char.Chem_shift_val _Peak_char.Details _Peak_char.Entry_ID _Peak_char.Spectral_peak_list_ID 1 1 7.2413 t_1H bmse011185 1 2 1 3.2699 s_4H bmse011185 1 3 1 2.6030 DMSO bmse011185 1 4 1 2.4854 Imp1 bmse011185 1 5 1 1.0929 m_6H bmse011185 1 6 1 7.1847 s_1H bmse011185 1 7 1 3.5683 q_3H bmse011185 1 8 1 2.7168 Imp2 bmse011185 1 9 1 6.5476 s_1H bmse011185 1 10 1 6.9907 dd_1H_Q1 bmse011185 1 11 1 2.1908 d_4H bmse011185 1 12 1 2.2665 m_4H bmse011185 1 13 1 7.1552 m_1H bmse011185 1 stop_ loop_ _Peak_coupling.ID _Peak_coupling.Peak_ID _Peak_coupling.Spectral_dim_ID _Peak_coupling.Coupling_val _Peak_coupling.Entry_ID _Peak_coupling.Spectral_peak_list_ID 1 1 1 7.6477 bmse011185 1 2 2 1 0.0000 bmse011185 1 3 3 1 1.8982 bmse011185 1 4 4 1 0.0000 bmse011185 1 5 5 1 7.0975 bmse011185 1 6 6 1 0.0000 bmse011185 1 7 7 1 7.0792 bmse011185 1 8 8 1 0.0000 bmse011185 1 9 9 1 0.0000 bmse011185 1 10 10 1 6.3273 bmse011185 1 11 10 1 1.0454 bmse011185 1 12 11 1 0.7703 bmse011185 1 13 12 1 0.0000 bmse011185 1 14 13 1 3.1545 bmse011185 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011185 1 2 bmse011185 1 3 bmse011185 1 4 bmse011185 1 5 bmse011185 1 6 bmse011185 1 7 bmse011185 1 8 bmse011185 1 9 bmse011185 1 10 bmse011185 1 11 bmse011185 1 12 bmse011185 1 13 bmse011185 1 14 bmse011185 1 15 bmse011185 1 16 bmse011185 1 17 bmse011185 1 18 bmse011185 1 19 bmse011185 1 20 bmse011185 1 21 bmse011185 1 22 bmse011185 1 23 bmse011185 1 24 bmse011185 1 25 bmse011185 1 26 bmse011185 1 27 bmse011185 1 28 bmse011185 1 29 bmse011185 1 30 bmse011185 1 31 bmse011185 1 stop_ loop_ _Spectral_transition_char.Spectral_transition_ID _Spectral_transition_char.Spectral_dim_ID _Spectral_transition_char.Chem_shift_val _Spectral_transition_char.Entry_ID _Spectral_transition_char.Spectral_peak_list_ID 1 1 7.2286 bmse011185 1 2 1 7.2414 bmse011185 1 3 1 7.2540 bmse011185 1 4 1 3.2699 bmse011185 1 5 1 2.5967 bmse011185 1 6 1 2.6001 bmse011185 1 7 1 2.6031 bmse011185 1 8 1 2.6062 bmse011185 1 9 1 2.6093 bmse011185 1 10 1 2.4854 bmse011185 1 11 1 1.1048 bmse011185 1 12 1 1.0928 bmse011185 1 13 1 1.0811 bmse011185 1 14 1 7.1847 bmse011185 1 15 1 3.5506 bmse011185 1 16 1 3.5625 bmse011185 1 17 1 3.5743 bmse011185 1 18 1 3.5860 bmse011185 1 19 1 2.7168 bmse011185 1 20 1 6.5476 bmse011185 1 21 1 6.9968 bmse011185 1 22 1 6.9944 bmse011185 1 23 1 6.9856 bmse011185 1 24 1 6.9845 bmse011185 1 25 1 2.1902 bmse011185 1 26 1 2.1915 bmse011185 1 27 1 2.2665 bmse011185 1 28 1 7.1631 bmse011185 1 29 1 7.1605 bmse011185 1 30 1 7.1517 bmse011185 1 31 1 7.1473 bmse011185 1 stop_ save_