######################### # 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 bmse011104 _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 bmse011104 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 bmse011104 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011104 1 2 bmse011104 1 3 bmse011104 1 4 bmse011104 1 5 bmse011104 1 6 bmse011104 1 7 bmse011104 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 1.9575 8,9_m bmse011104 1 2 1 4.6500 SUP bmse011104 1 3 1 2.6029 DMSO bmse011104 1 4 1 0.9790 10_d_Q1 bmse011104 1 5 1 1.4426 9_m_Q2 bmse011104 1 6 1 3.2168 7_m bmse011104 1 7 1 1.8002 5_m bmse011104 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 1 102.9125 bmse011104 1 2 2 1 0.0000 bmse011104 1 3 3 1 1.8156 bmse011104 1 4 4 1 7.0425 bmse011104 1 5 5 1 2.9511 bmse011104 1 6 6 1 76.1340 bmse011104 1 7 7 1 80.6325 bmse011104 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011104 1 2 bmse011104 1 3 bmse011104 1 4 bmse011104 1 5 bmse011104 1 6 bmse011104 1 7 bmse011104 1 8 bmse011104 1 9 bmse011104 1 10 bmse011104 1 11 bmse011104 1 12 bmse011104 1 13 bmse011104 1 14 bmse011104 1 15 bmse011104 1 16 bmse011104 1 17 bmse011104 1 18 bmse011104 1 19 bmse011104 1 20 bmse011104 1 21 bmse011104 1 22 bmse011104 1 23 bmse011104 1 24 bmse011104 1 25 bmse011104 1 26 bmse011104 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 2.0432 bmse011104 1 2 1 1.8717 bmse011104 1 3 1 4.6500 bmse011104 1 4 1 2.5968 bmse011104 1 5 1 2.5998 bmse011104 1 6 1 2.6029 bmse011104 1 7 1 2.6060 bmse011104 1 8 1 2.6089 bmse011104 1 9 1 0.9731 bmse011104 1 10 1 0.9849 bmse011104 1 11 1 1.4696 bmse011104 1 12 1 1.4632 bmse011104 1 13 1 1.4627 bmse011104 1 14 1 1.4581 bmse011104 1 15 1 1.4515 bmse011104 1 16 1 1.4460 bmse011104 1 17 1 1.4392 bmse011104 1 18 1 1.4339 bmse011104 1 19 1 1.4271 bmse011104 1 20 1 1.4229 bmse011104 1 21 1 1.4216 bmse011104 1 22 1 1.4155 bmse011104 1 23 1 3.2803 bmse011104 1 24 1 3.1534 bmse011104 1 25 1 1.8674 bmse011104 1 26 1 1.7330 bmse011104 1 stop_ save_