Dataset

5b_Varian.

This dataset contains NMR spectra obtained for the sample -5b_Varian name: 5b_HEE298_20140213_05.13C.fid phc0: 52.3137167226 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532776997 spectralWidth: 248.67511618371017 numberOfPoints: 32768 frequencyOffset: 11058.102999996321 originFrequency: 100.5438351 name: 5b_HEE298_20140213_05.1H.fid phc0: -77.1954338172 isFid: true nucleus: 1H solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 399.811877033 spectralWidth: 17.96822070242563 numberOfPoints: 16384 frequencyOffset: 2798.8670000240745 originFrequency: 399.8146759 name: 5b_HEE298_20140213_05.dept.fid phc0: -37.7 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532776998 spectralWidth: 248.67511618123658 numberOfPoints: 32768 frequencyOffset: 11058.101999992687 originFrequency: 100.5438351

Chemical Info

InChI	InChI=1S/C15H26O2/c1-2-3-4-5-6-7-8-9-11-14(16)15-12-10-13-17-15/h10,12-14,16H,2-9,11H2,1H3
SMILES	CCCCCCCCCCC(O)C1=CC=CO1
InChI Key	XDKMPPWBMLMXLH-UHFFFAOYSA-N
Molecular Formula	C15H26O2
Exact Mass	238.370 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI	10.57992/nmrxiv.p57.s374.d1939
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D1939
Version
Author	Toni Ditfe, Dr. Eileen Bette, Dr. Haider N. Sultani, Dr. Alexander Otto, Prof. Dr. Ludger A. Wessjohann, Dr. Norbert Arnold, Prof. Dr. Bernhard Westermann
Maintainer
Language	english
MetadataCreated	2024-05-15T09:18:28.173742
MetadataModified	2024-05-15T09:18:28.173750
MetadataPublished	2024-01-19 09:20:10

Field	Value
Measurement Technique
Measurement Variables	NMR solvent : cdcl3 acquisition nucleus : 1H NMR spectrum by dimensionality : 1 NMR probe : Temperature : 25 K magnetic field strength : Tesla number of scans : scans nuclear magnetic resonance pulse sequence : Spectral Width : 17.96822070242563 number of data points : 16384 points relaxation time measurement : seconds