DOI: 10.57992/nmrxiv.p159.s1617
title: 6-epi-11-deoxytetrodotoxin

description: This dataset contains NMR spectra obtained for the sample -6-epi-11-deoxytetrodotoxin Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: 1d Temperature: 293.1515 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 100 NMR Pulse Sequence: zg30 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 1 Observed Frequency: 600.183706111 Nucleus: 1H,1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: cosy Temperature: 293.1494 Observed Frequency: 600.18,600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 60 NMR Pulse Sequence: cosygpppqf Spectral Width: 5.95057883902155,5.95057883902155 Number of Data Points: 2048,200 Relaxation Delay: 2 Observed Frequency: 600.181708039653,600.181708039653 Nucleus: 1H,13C NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: hmbc Temperature: 293.1503 Observed Frequency: 600.18,150.915381036 Magnetic Field Strength: 14.096184638414169 Number of Scans: 340 NMR Pulse Sequence: hmbcetgpl3nd Spectral Width: 5.95057883902155,220 Number of Data Points: 4096,128 Relaxation Delay: 2 Observed Frequency: 600.181708039653,150.930472574 Nucleus: 1H,13C NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: hsqc Temperature: 293.3904 Observed Frequency: 600.18,150.915381036 Magnetic Field Strength: 14.096184638414169 Number of Scans: 240 NMR Pulse Sequence: hsqcedetgpsisp2.3 Spectral Width: 5.95057883902155,165 Number of Data Points: 2048,128 Relaxation Delay: 1.5 Observed Frequency: 600.181708039653,150.92669969 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1477 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1469 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1497 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1489 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1483 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1489 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1516 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1512 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1505 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1501 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2400 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 19.8351967631727 Number of Data Points: 65536 Relaxation Delay: 2 Observed Frequency: 600.183706111 Nucleus: 1H,1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: tocsy Temperature: 293.1503 Observed Frequency: 600.18,600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 48 NMR Pulse Sequence: mlevphpp Spectral Width: 5.95057883902155,5.95057883902155 Number of Data Points: 2048,200 Relaxation Delay: 2 Observed Frequency: 600.181708039653,600.181708039653