######################### # 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 bmse011018 _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 bmse011018 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 bmse011018 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011018 1 2 bmse011018 1 3 bmse011018 1 4 bmse011018 1 5 bmse011018 1 6 bmse011018 1 7 bmse011018 1 8 bmse011018 1 9 bmse011018 1 10 bmse011018 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 4.6500 SUP bmse011018 1 2 1 7.9541 6,7_m_Q3 bmse011018 1 3 1 3.7210 5_m_Q2 bmse011018 1 4 1 2.6027 DMSO bmse011018 1 5 1 3.1123 12,13_m bmse011018 1 6 1 3.4402 12,13_m bmse011018 1 7 1 3.8379 16_s bmse011018 1 8 1 2.0519 14,15_d_Q1 bmse011018 1 9 1 1.8040 14,15_m bmse011018 1 10 1 7.0374 9,10_m bmse011018 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 0.0000 bmse011018 1 2 2 1 4.5116 bmse011018 1 3 3 1 3.7276 bmse011018 1 4 4 1 1.8156 bmse011018 1 5 5 1 5.7441 bmse011018 1 6 6 1 4.0054 bmse011018 1 7 7 1 0.0000 bmse011018 1 8 8 1 12.7646 bmse011018 1 9 9 1 4.2805 bmse011018 1 10 10 1 2.9491 bmse011018 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011018 1 2 bmse011018 1 3 bmse011018 1 4 bmse011018 1 5 bmse011018 1 6 bmse011018 1 7 bmse011018 1 8 bmse011018 1 9 bmse011018 1 10 bmse011018 1 11 bmse011018 1 12 bmse011018 1 13 bmse011018 1 14 bmse011018 1 15 bmse011018 1 16 bmse011018 1 17 bmse011018 1 18 bmse011018 1 19 bmse011018 1 20 bmse011018 1 21 bmse011018 1 22 bmse011018 1 23 bmse011018 1 24 bmse011018 1 25 bmse011018 1 26 bmse011018 1 27 bmse011018 1 28 bmse011018 1 29 bmse011018 1 30 bmse011018 1 31 bmse011018 1 32 bmse011018 1 33 bmse011018 1 34 bmse011018 1 35 bmse011018 1 36 bmse011018 1 37 bmse011018 1 38 bmse011018 1 39 bmse011018 1 40 bmse011018 1 41 bmse011018 1 42 bmse011018 1 43 bmse011018 1 44 bmse011018 1 45 bmse011018 1 46 bmse011018 1 47 bmse011018 1 48 bmse011018 1 49 bmse011018 1 50 bmse011018 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 4.6500 bmse011018 1 2 1 7.9616 bmse011018 1 3 1 7.9498 bmse011018 1 4 1 7.9465 bmse011018 1 5 1 3.7459 bmse011018 1 6 1 3.7398 bmse011018 1 7 1 3.7338 bmse011018 1 8 1 3.7270 bmse011018 1 9 1 3.7209 bmse011018 1 10 1 3.7149 bmse011018 1 11 1 3.7083 bmse011018 1 12 1 3.7022 bmse011018 1 13 1 3.6962 bmse011018 1 14 1 2.5967 bmse011018 1 15 1 2.5996 bmse011018 1 16 1 2.6027 bmse011018 1 17 1 2.6058 bmse011018 1 18 1 2.6088 bmse011018 1 19 1 3.1363 bmse011018 1 20 1 3.1311 bmse011018 1 21 1 3.1148 bmse011018 1 22 1 3.1098 bmse011018 1 23 1 3.0935 bmse011018 1 24 1 3.0884 bmse011018 1 25 1 3.4569 bmse011018 1 26 1 3.4511 bmse011018 1 27 1 3.4452 bmse011018 1 28 1 3.4351 bmse011018 1 29 1 3.4292 bmse011018 1 30 1 3.4236 bmse011018 1 31 1 3.8379 bmse011018 1 32 1 2.0413 bmse011018 1 33 1 2.0626 bmse011018 1 34 1 1.8396 bmse011018 1 35 1 1.8328 bmse011018 1 36 1 1.8189 bmse011018 1 37 1 1.8141 bmse011018 1 38 1 1.8079 bmse011018 1 39 1 1.7965 bmse011018 1 40 1 1.7932 bmse011018 1 41 1 1.7894 bmse011018 1 42 1 1.7888 bmse011018 1 43 1 1.7751 bmse011018 1 44 1 1.7683 bmse011018 1 45 1 7.0252 bmse011018 1 46 1 7.0300 bmse011018 1 47 1 7.0335 bmse011018 1 48 1 7.0414 bmse011018 1 49 1 7.0448 bmse011018 1 50 1 7.0498 bmse011018 1 stop_ save_