######################### # 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 bmse011670 _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 bmse011670 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 bmse011670 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011670 1 2 bmse011670 1 3 bmse011670 1 4 bmse011670 1 5 bmse011670 1 6 bmse011670 1 7 bmse011670 1 8 bmse011670 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 2.9969 13_q_Q2 bmse011670 1 2 1 4.1100 3_s bmse011670 1 3 1 1.1594 16_t_Q1 bmse011670 1 4 1 6.8030 11,15_m bmse011670 1 5 1 5.8995 9_s_Q3 bmse011670 1 6 1 2.6025 DMSO bmse011670 1 7 1 6.8688 10_s bmse011670 1 8 1 4.6500 SUP bmse011670 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 7.4093 bmse011670 1 2 2 1 0.0000 bmse011670 1 3 3 1 7.3726 bmse011670 1 4 4 1 42.8977 bmse011670 1 5 5 1 0.0000 bmse011670 1 6 6 1 0.0000 bmse011670 1 7 7 1 0.0000 bmse011670 1 8 8 1 0.0000 bmse011670 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011670 1 2 bmse011670 1 3 bmse011670 1 4 bmse011670 1 5 bmse011670 1 6 bmse011670 1 7 bmse011670 1 8 bmse011670 1 9 bmse011670 1 10 bmse011670 1 11 bmse011670 1 12 bmse011670 1 13 bmse011670 1 14 bmse011670 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 2.9784 bmse011670 1 2 1 2.9909 bmse011670 1 3 1 3.0031 bmse011670 1 4 1 3.0154 bmse011670 1 5 1 4.1100 bmse011670 1 6 1 1.1471 bmse011670 1 7 1 1.1594 bmse011670 1 8 1 1.1717 bmse011670 1 9 1 6.8388 bmse011670 1 10 1 6.7673 bmse011670 1 11 1 5.8995 bmse011670 1 12 1 2.6025 bmse011670 1 13 1 6.8688 bmse011670 1 14 1 4.6500 bmse011670 1 stop_ save_