DOI: 10.57992/nmrxiv.p159.s1618
title: 1-hydroxy-4,9-anhydro-8-epi-10-hemiketal-5,6,11-trideoxytetrodotoxin

description: This dataset contains NMR spectra obtained for the sample -1-hydroxy-4,9-anhydro-8-epi-10-hemiketal-5,6,11-trideoxytetrodotoxin Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: 1d Temperature: 293.1474 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: 293.1511 Observed Frequency: 600.18,600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 88 NMR Pulse Sequence: cosygpppqf Spectral Width: 6.40831738734015,6.40831738734016 Number of Data Points: 2048,128 Relaxation Delay: 2 Observed Frequency: 600.181547460813,600.181547460813 Nucleus: 1H,13C NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: hmbc Temperature: 293.1521 Observed Frequency: 600.18,150.915381036 Magnetic Field Strength: 14.096184638414169 Number of Scans: 340 NMR Pulse Sequence: hmbcetgpl3nd Spectral Width: 5.9505789409751,220 Number of Data Points: 4096,128 Relaxation Delay: 2 Observed Frequency: 600.18169775651,150.930472574 Nucleus: 1H,13C NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: hsqc Temperature: 293.4963 Observed Frequency: 600.18,150.915381036 Magnetic Field Strength: 14.096184638414169 Number of Scans: 160 NMR Pulse Sequence: hsqcedetgpsisp2.3 Spectral Width: 5.9505789409751,165 Number of Data Points: 2048,128 Relaxation Delay: 1.5 Observed Frequency: 600.18169775651,150.92669969 Nucleus: 1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: null Temperature: 293.1484 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 14.3634183457457 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: 293.149 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 14.3634183457457 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: 293.1519 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 14.3634183457457 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: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 14.3634183457457 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: 293.1487 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 14.3634183457457 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: 293.1494 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 14.3634183457457 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: 293.1506 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 14.3634183457457 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: 293.1491 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 2000 NMR Pulse Sequence: selnogpzs.2 Spectral Width: 14.3634183457457 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: noesy Temperature: 293.1511 Observed Frequency: 600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 100 NMR Pulse Sequence: noesygppr1d Spectral Width: 20.8269873209306 Number of Data Points: 32768 Relaxation Delay: 2 Observed Frequency: 600.182820846 Nucleus: 1H,1H NMR Solvent: D2O NMR Probe: Z816801_0204 (PA TXI 600S3 H-C/N-D-05 Z) NMR Pulse Sequence: tocsy Temperature: 293.1491 Observed Frequency: 600.18,600.18 Magnetic Field Strength: 14.096184638414169 Number of Scans: 72 NMR Pulse Sequence: mlevphpp Spectral Width: 6.40831738734015,6.40831738734016 Number of Data Points: 2048,128 Relaxation Delay: 2 Observed Frequency: 600.181547460813,600.181547460813