######################### # 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 bmse011715 _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 bmse011715 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 bmse011715 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011715 1 2 bmse011715 1 3 bmse011715 1 4 bmse011715 1 5 bmse011715 1 6 bmse011715 1 7 bmse011715 1 8 bmse011715 1 9 bmse011715 1 10 bmse011715 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 2.6030 DMSO bmse011715 1 2 1 2.0366 12,13_m_Q1 bmse011715 1 3 1 4.6500 SUP bmse011715 1 4 1 1.6653 12,13_m bmse011715 1 5 1 1.5564 14,15_m bmse011715 1 6 1 4.0893 1_s bmse011715 1 7 1 3.5061 9_quint_Q2 bmse011715 1 8 1 6.9774 7,8_m bmse011715 1 9 1 7.3443 5,6_d_Q3 bmse011715 1 10 1 3.7717 11_s bmse011715 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 1.9532 bmse011715 1 2 2 1 4.1677 bmse011715 1 3 3 1 0.0000 bmse011715 1 4 4 1 6.2172 bmse011715 1 5 5 1 5.6120 bmse011715 1 6 6 1 0.0000 bmse011715 1 7 7 1 7.3726 bmse011715 1 8 8 1 2.9711 bmse011715 1 9 9 1 8.6931 bmse011715 1 10 10 1 0.0000 bmse011715 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011715 1 2 bmse011715 1 3 bmse011715 1 4 bmse011715 1 5 bmse011715 1 6 bmse011715 1 7 bmse011715 1 8 bmse011715 1 9 bmse011715 1 10 bmse011715 1 11 bmse011715 1 12 bmse011715 1 13 bmse011715 1 14 bmse011715 1 15 bmse011715 1 16 bmse011715 1 17 bmse011715 1 18 bmse011715 1 19 bmse011715 1 20 bmse011715 1 21 bmse011715 1 22 bmse011715 1 23 bmse011715 1 24 bmse011715 1 25 bmse011715 1 26 bmse011715 1 27 bmse011715 1 28 bmse011715 1 29 bmse011715 1 30 bmse011715 1 31 bmse011715 1 32 bmse011715 1 33 bmse011715 1 34 bmse011715 1 35 bmse011715 1 36 bmse011715 1 37 bmse011715 1 38 bmse011715 1 39 bmse011715 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 2.5965 bmse011715 1 2 1 2.6000 bmse011715 1 3 1 2.6029 bmse011715 1 4 1 2.6058 bmse011715 1 5 1 2.6095 bmse011715 1 6 1 2.0644 bmse011715 1 7 1 2.0562 bmse011715 1 8 1 2.0496 bmse011715 1 9 1 2.0430 bmse011715 1 10 1 2.0332 bmse011715 1 11 1 2.0307 bmse011715 1 12 1 2.0226 bmse011715 1 13 1 2.0175 bmse011715 1 14 1 2.0089 bmse011715 1 15 1 4.6500 bmse011715 1 16 1 1.6757 bmse011715 1 17 1 1.6596 bmse011715 1 18 1 1.6550 bmse011715 1 19 1 1.5798 bmse011715 1 20 1 1.5670 bmse011715 1 21 1 1.5547 bmse011715 1 22 1 1.5508 bmse011715 1 23 1 1.5415 bmse011715 1 24 1 1.5331 bmse011715 1 25 1 4.0893 bmse011715 1 26 1 3.4815 bmse011715 1 27 1 3.4936 bmse011715 1 28 1 3.5059 bmse011715 1 29 1 3.5176 bmse011715 1 30 1 3.5306 bmse011715 1 31 1 6.9647 bmse011715 1 32 1 6.9702 bmse011715 1 33 1 6.9737 bmse011715 1 34 1 6.9809 bmse011715 1 35 1 6.9845 bmse011715 1 36 1 6.9895 bmse011715 1 37 1 7.3371 bmse011715 1 38 1 7.3516 bmse011715 1 39 1 3.7717 bmse011715 1 stop_ save_