######################### # 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 bmse011534 _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 bmse011534 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 bmse011534 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011534 1 2 bmse011534 1 3 bmse011534 1 5 bmse011534 1 6 bmse011534 1 8 bmse011534 1 9 bmse011534 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 6.7318 1,10,11_m_Q2 bmse011534 1 2 1 2.6029 DMSO bmse011534 1 3 1 3.9711 6_dd_Q1 bmse011534 1 4 1 1.1798 12_d bmse011534 1 5 1 3.8139 6_dd bmse011534 1 6 1 7.2617 8_q_Q3 bmse011534 1 7 1 4.6500 SUP bmse011534 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 72.4605 bmse011534 1 2 2 1 1.8156 bmse011534 1 3 3 1 10.1236 bmse011534 1 4 3 1 3.1911 bmse011534 1 5 4 1 6.4923 bmse011534 1 6 5 1 10.1786 bmse011534 1 7 5 1 7.4277 bmse011534 1 8 6 1 7.8495 bmse011534 1 9 7 1 0.0000 bmse011534 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011534 1 2 bmse011534 1 3 bmse011534 1 4 bmse011534 1 5 bmse011534 1 6 bmse011534 1 7 bmse011534 1 8 bmse011534 1 9 bmse011534 1 10 bmse011534 1 11 bmse011534 1 12 bmse011534 1 13 bmse011534 1 14 bmse011534 1 15 bmse011534 1 16 bmse011534 1 17 bmse011534 1 18 bmse011534 1 19 bmse011534 1 20 bmse011534 1 21 bmse011534 1 22 bmse011534 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 6.7922 bmse011534 1 2 1 6.6715 bmse011534 1 3 1 2.5968 bmse011534 1 4 1 2.5998 bmse011534 1 5 1 2.6029 bmse011534 1 6 1 2.6060 bmse011534 1 7 1 2.6089 bmse011534 1 8 1 3.9822 bmse011534 1 9 1 3.9769 bmse011534 1 10 1 3.9653 bmse011534 1 11 1 3.9600 bmse011534 1 12 1 1.1744 bmse011534 1 13 1 1.1853 bmse011534 1 14 1 3.8286 bmse011534 1 15 1 3.8161 bmse011534 1 16 1 3.8115 bmse011534 1 17 1 3.7992 bmse011534 1 18 1 7.2421 bmse011534 1 19 1 7.2555 bmse011534 1 20 1 7.2678 bmse011534 1 21 1 7.2814 bmse011534 1 22 1 4.6500 bmse011534 1 stop_ save_