DOI: 10.57992/nmrxiv.p112.s1159
title: PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D

description: This dataset contains NMR spectra obtained for the sample -PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D date: 2024-01-05T08:46:05.000Z isFt: true name: PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D/1 phc0: -119.8318 phc1: 40.09481 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 20 nucleus: 1H reverse: false solvent: DMSO dimension: 1 increment: 4.165744509690375 isComplex: true probeName: Z168272_0003 (CP2.1 QCI 600S3 H&F-P/C/N-D-05 Z XT) experiment: null groupDelay: 67.9862518310547 temperature: 299.9981 spectrumSize: 131072 baseFrequency: 600.13 fieldStrength: 14.095010340939984 numberOfScans: 8 pulseSequence: MF1h spectralWidth: 16.6629780387615 numberOfPoints: 5 relaxationTime: 1.3 acquisitionTime: 0.00019999999999999982 frequencyOffset: 2820.000000042455 originFrequency: 600.13282 pulseStrength90: 40192.92604501608 experimentNumber: 1 acquisitionScheme: undefined linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 4 date: 2024-01-05T08:48:32.000Z isFt: true name: PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D/2 phc0: -12.91297,0 phc1: -7.200001,0 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 20 nucleus: 1H,13C reverse: false,true solvent: DMSO dimension: 2 increment: 16.6629780387615 isComplex: false probeName: Z168272_0003 (CP2.1 QCI 600S3 H&F-P/C/N-D-05 Z XT) experiment: hmqc groupDelay: 67.9862518310547 temperature: 299.9997 spectrumSize: 4096,2048 baseFrequency: 600.13,150.902809 fieldStrength: 14.095010340939984 numberOfScans: 16 pulseSequence: MFhmqceaf2 spectralWidth: 16.6629780387615,161.615899907689 numberOfPoints: 2 relaxationTime: 1 acquisitionTime: 0.000049999999999999955 frequencyOffset: 2820.000000042455,12069.526000004771 originFrequency: 600.13282,150.914878526 pulseStrength90: 40192.92604501608 experimentNumber: 2 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4 date: 2024-01-05T10:03:20.000Z isFt: true name: PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D/3 phc0: 67.76595,-174.5183 phc1: 6.836792,0 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 20 nucleus: 1H,13C reverse: false,false solvent: DMSO dimension: 2 increment: 8.33148901938075 isComplex: false probeName: Z168272_0003 (CP2.1 QCI 600S3 H&F-P/C/N-D-05 Z XT) experiment: hsqc groupDelay: 67.9862518310547 temperature: 299.9987 spectrumSize: 4096,2048 baseFrequency: 600.13,150.902809 fieldStrength: 14.095010340939984 numberOfScans: 32 pulseSequence: MFhsqceaf2 spectralWidth: 16.6629780387615,161.615899907689 numberOfPoints: 3 relaxationTime: 1 acquisitionTime: 0.00009999999999999991 frequencyOffset: 2820.000000042455,12069.526000004771 originFrequency: 600.13282,150.914878526 pulseStrength90: 40192.92604501608 experimentNumber: 3 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4 date: 2024-01-05T13:44:34.000Z isFt: true name: PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D/4 phc0: -120.3748,-91.60903 phc1: 33.12416,-180 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.6.2 DSPFVS: 20 nucleus: 1H,1H reverse: false,false solvent: DMSO dimension: 2 increment: 8.33148901938075 isComplex: false probeName: Z168272_0003 (CP2.1 QCI 600S3 H&F-P/C/N-D-05 Z XT) experiment: cosy groupDelay: 67.9862518310547 temperature: 300.0004 spectrumSize: 4096,2048 baseFrequency: 600.13,600.13 fieldStrength: 14.095010340939984 numberOfScans: 16 pulseSequence: MFclipcosy spectralWidth: 16.6629780387615,13.8858150323012 numberOfPoints: 3 relaxationTime: 1.3 acquisitionTime: 0.00009999999999999991 frequencyOffset: 2820.000000042455,2820.000000042455 originFrequency: 600.13282,600.13282 pulseStrength90: 40192.92604501608 experimentNumber: 4 acquisitionScheme: States-TPPI linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4 date: 2024-01-05T17:28:39.000Z isFt: true name: PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D/5 phc0: 0,0 phc1: 0,0 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.6.2 DSPFVS: 20 nucleus: 1H,13C reverse: false,false solvent: DMSO dimension: 2 increment: 8.33148901938075 isComplex: false probeName: Z168272_0003 (CP2.1 QCI 600S3 H&F-P/C/N-D-05 Z XT) experiment: hmbc groupDelay: 67.9862518310547 temperature: 300.0014 spectrumSize: 4096,2048 baseFrequency: 600.13,150.902809 fieldStrength: 14.095010340939984 numberOfScans: 64 pulseSequence: MFhmbceaf2 spectralWidth: 16.6629780387615,207.066694592838 numberOfPoints: 3 relaxationTime: 1.3 acquisitionTime: 0.00009999999999999991 frequencyOffset: 2820.000000042455,14749.526000002788 originFrequency: 600.13282,150.917558526 pulseStrength90: 40192.92604501608 experimentNumber: 5 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 3,4 date: 2024-01-06T22:33:49.000Z isFt: true name: PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D/6 phc0: -303.208,0 phc1: 33.6,0 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.6.2 DSPFVS: 20 nucleus: 1H,1H reverse: false,false solvent: DMSO dimension: 2 increment: 1.5148161853419546 isComplex: false probeName: Z168272_0003 (CP2.1 QCI 600S3 H&F-P/C/N-D-05 Z XT) experiment: noesy groupDelay: 67.9862518310547 temperature: 300.0004 spectrumSize: 4096,2048 baseFrequency: 600.13,600.13 fieldStrength: 14.095010340939984 numberOfScans: 128 pulseSequence: MFnoesy spectralWidth: 16.6629780387615,13.8858150323012 numberOfPoints: 12 relaxationTime: 1.3 acquisitionTime: 0.0005499999999999995 frequencyOffset: 2820.000000042455,2820.000000042455 originFrequency: 600.13282,600.13282 pulseStrength90: 40192.92604501608 experimentNumber: 6 acquisitionScheme: States-TPPI linearPredictionBin: 0,512 lpNumberOfCoefficients: 0,8 windowMultiplicationMode: 4,4 date: 2024-01-08T04:15:17.000Z isFt: true name: PCC9009_Schanbacher_ACBderivatives_cmp_2_Dihydroanhydrocyanobacterin D/7 phc0: -14.55782,3.508594 phc1: -1.900001,2.2 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.6.2 DSPFVS: 20 nucleus: 1H,13C reverse: false,false solvent: DMSO dimension: 2 increment: 5.554326012920501 isComplex: false probeName: Z168272_0003 (CP2.1 QCI 600S3 H&F-P/C/N-D-05 Z XT) experiment: hsqc groupDelay: 67.9862518310547 temperature: 300.0005 spectrumSize: 4096,2048 baseFrequency: 600.13,150.902809 fieldStrength: 14.095010340939984 numberOfScans: 32 pulseSequence: MFhsqceaclipcosyf2 spectralWidth: 16.6629780387615,161.615899907689 numberOfPoints: 4 relaxationTime: 1 acquisitionTime: 0.00014999999999999985 frequencyOffset: 2820.000000042455,12069.526000004771 originFrequency: 600.13282,150.914878526 pulseStrength90: 40192.92604501608 experimentNumber: 7 acquisitionScheme: Echo-antiecho linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4