######################### # 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 bmse011200 _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 bmse011200 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 bmse011200 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011200 1 2 bmse011200 1 3 bmse011200 1 4 bmse011200 1 6 bmse011200 1 7 bmse011200 1 8 bmse011200 1 9 bmse011200 1 10 bmse011200 1 11 bmse011200 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 2.8386 8,9_m_Q3 bmse011200 1 2 1 4.6500 SUP bmse011200 1 3 1 1.6249 10,11_m bmse011200 1 4 1 2.5307 3_dd bmse011200 1 5 1 1.3970 12_m_Q1 bmse011200 1 6 1 1.8615 10,11_d_Q2 bmse011200 1 7 1 2.6030 DMSO bmse011200 1 8 1 3.4365 8,9_d bmse011200 1 9 1 1.7236 12_m bmse011200 1 10 1 3.2102 5_t bmse011200 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 6.9050 bmse011200 1 2 2 1 0.0000 bmse011200 1 3 3 1 6.7596 bmse011200 1 4 4 1 7.0975 bmse011200 1 5 4 1 7.0975 bmse011200 1 6 5 1 6.0050 bmse011200 1 7 6 1 14.6352 bmse011200 1 8 7 1 1.9532 bmse011200 1 9 8 1 12.4344 bmse011200 1 10 9 1 6.8224 bmse011200 1 11 10 1 7.0975 bmse011200 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011200 1 2 bmse011200 1 3 bmse011200 1 4 bmse011200 1 5 bmse011200 1 6 bmse011200 1 7 bmse011200 1 8 bmse011200 1 9 bmse011200 1 10 bmse011200 1 11 bmse011200 1 12 bmse011200 1 13 bmse011200 1 14 bmse011200 1 15 bmse011200 1 16 bmse011200 1 17 bmse011200 1 18 bmse011200 1 19 bmse011200 1 20 bmse011200 1 21 bmse011200 1 22 bmse011200 1 23 bmse011200 1 24 bmse011200 1 25 bmse011200 1 26 bmse011200 1 27 bmse011200 1 28 bmse011200 1 29 bmse011200 1 30 bmse011200 1 31 bmse011200 1 32 bmse011200 1 33 bmse011200 1 34 bmse011200 1 35 bmse011200 1 36 bmse011200 1 37 bmse011200 1 38 bmse011200 1 39 bmse011200 1 40 bmse011200 1 41 bmse011200 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 2.8616 bmse011200 1 2 1 2.8401 bmse011200 1 3 1 2.8368 bmse011200 1 4 1 2.8191 bmse011200 1 5 1 2.8156 bmse011200 1 6 1 4.6500 bmse011200 1 7 1 1.6643 bmse011200 1 8 1 1.6579 bmse011200 1 9 1 1.6521 bmse011200 1 10 1 1.6367 bmse011200 1 11 1 1.6148 bmse011200 1 12 1 1.5963 bmse011200 1 13 1 1.5910 bmse011200 1 14 1 1.5855 bmse011200 1 15 1 2.5426 bmse011200 1 16 1 2.5307 bmse011200 1 17 1 2.5307 bmse011200 1 18 1 2.5189 bmse011200 1 19 1 1.4320 bmse011200 1 20 1 1.4256 bmse011200 1 21 1 1.4194 bmse011200 1 22 1 1.4042 bmse011200 1 23 1 1.3981 bmse011200 1 24 1 1.3890 bmse011200 1 25 1 1.3825 bmse011200 1 26 1 1.3620 bmse011200 1 27 1 1.8493 bmse011200 1 28 1 1.8737 bmse011200 1 29 1 2.5965 bmse011200 1 30 1 2.6001 bmse011200 1 31 1 2.6031 bmse011200 1 32 1 2.6060 bmse011200 1 33 1 2.6095 bmse011200 1 34 1 3.4261 bmse011200 1 35 1 3.4468 bmse011200 1 36 1 1.7349 bmse011200 1 37 1 1.7156 bmse011200 1 38 1 1.7122 bmse011200 1 39 1 3.1984 bmse011200 1 40 1 3.2101 bmse011200 1 41 1 3.2221 bmse011200 1 stop_ save_