######################### # 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 bmse011013 _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 bmse011013 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 bmse011013 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011013 1 2 bmse011013 1 3 bmse011013 1 4 bmse011013 1 5 bmse011013 1 6 bmse011013 1 7 bmse011013 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 7.4288 d_1H_Q1 bmse011013 1 2 1 3.6197 m_1H bmse011013 1 3 1 3.1947 m_3H bmse011013 1 4 1 3.9321 t_1H bmse011013 1 5 1 3.3354 t_1H bmse011013 1 6 1 8.6048 d_1H bmse011013 1 7 1 2.6026 DMSO bmse011013 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 5.9421 bmse011013 1 2 2 1 5.2819 bmse011013 1 3 3 1 0.0000 bmse011013 1 4 4 1 5.2269 bmse011013 1 5 5 1 5.3919 bmse011013 1 6 6 1 5.8321 bmse011013 1 7 7 1 1.9532 bmse011013 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011013 1 2 bmse011013 1 3 bmse011013 1 4 bmse011013 1 5 bmse011013 1 6 bmse011013 1 7 bmse011013 1 8 bmse011013 1 9 bmse011013 1 10 bmse011013 1 11 bmse011013 1 12 bmse011013 1 13 bmse011013 1 14 bmse011013 1 15 bmse011013 1 16 bmse011013 1 17 bmse011013 1 18 bmse011013 1 19 bmse011013 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 7.4238 bmse011013 1 2 1 7.4337 bmse011013 1 3 1 3.6285 bmse011013 1 4 1 3.6199 bmse011013 1 5 1 3.6109 bmse011013 1 6 1 3.1947 bmse011013 1 7 1 3.9234 bmse011013 1 8 1 3.9322 bmse011013 1 9 1 3.9408 bmse011013 1 10 1 3.3264 bmse011013 1 11 1 3.3352 bmse011013 1 12 1 3.3443 bmse011013 1 13 1 8.6000 bmse011013 1 14 1 8.6097 bmse011013 1 15 1 2.5961 bmse011013 1 16 1 2.6000 bmse011013 1 17 1 2.6027 bmse011013 1 18 1 2.6055 bmse011013 1 19 1 2.6091 bmse011013 1 stop_ save_