######################### # 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 bmse011443 _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 bmse011443 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 bmse011443 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011443 1 2 bmse011443 1 3 bmse011443 1 4 bmse011443 1 5 bmse011443 1 6 bmse011443 1 7 bmse011443 1 8 bmse011443 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 1.5454 18_quint_Q1 bmse011443 1 2 1 2.5937 DMSO_9_m bmse011443 1 3 1 4.6500 SUP bmse011443 1 4 1 7.3738 10,11_d bmse011443 1 5 1 7.2101 6,7_d_Q3 bmse011443 1 6 1 1.7328 16,17_Q2 bmse011443 1 7 1 1.1059 14,15_d bmse011443 1 8 1 3.1814 12,13_t bmse011443 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 5.8596 bmse011443 1 2 2 1 82.9645 bmse011443 1 3 3 1 0.0000 bmse011443 1 4 4 1 8.8031 bmse011443 1 5 5 1 8.9132 bmse011443 1 6 6 1 5.6945 bmse011443 1 7 7 1 6.8224 bmse011443 1 8 8 1 5.5570 bmse011443 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011443 1 2 bmse011443 1 3 bmse011443 1 4 bmse011443 1 5 bmse011443 1 6 bmse011443 1 7 bmse011443 1 8 bmse011443 1 9 bmse011443 1 10 bmse011443 1 11 bmse011443 1 12 bmse011443 1 13 bmse011443 1 14 bmse011443 1 15 bmse011443 1 16 bmse011443 1 17 bmse011443 1 18 bmse011443 1 19 bmse011443 1 20 bmse011443 1 21 bmse011443 1 22 bmse011443 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 1.5259 bmse011443 1 2 1 1.5356 bmse011443 1 3 1 1.5453 bmse011443 1 4 1 1.5547 bmse011443 1 5 1 1.5650 bmse011443 1 6 1 2.6628 bmse011443 1 7 1 2.5246 bmse011443 1 8 1 4.6500 bmse011443 1 9 1 7.3664 bmse011443 1 10 1 7.3811 bmse011443 1 11 1 7.2027 bmse011443 1 12 1 7.2176 bmse011443 1 13 1 1.7138 bmse011443 1 14 1 1.7239 bmse011443 1 15 1 1.7329 bmse011443 1 16 1 1.7419 bmse011443 1 17 1 1.7518 bmse011443 1 18 1 1.1002 bmse011443 1 19 1 1.1116 bmse011443 1 20 1 3.1722 bmse011443 1 21 1 3.1815 bmse011443 1 22 1 3.1907 bmse011443 1 stop_ save_