Dataset

5c_Varian.

This dataset contains NMR spectra obtained for the sample -5c_Varian name: 5c_HEE152_20130301_01.13C.fid phc0: 143.338821831 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532776682 spectralWidth: 248.6751169628855 numberOfPoints: 32768 frequencyOffset: 11058.417999990412 originFrequency: 100.5438351 name: 5c_HEE152_20130301_01.1H.fid phc0: -57.8027744944 isFid: true nucleus: 1H solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 399.811876786 spectralWidth: 17.96822071352622 numberOfPoints: 16384 frequencyOffset: 2799.1139999699044 originFrequency: 399.8146759 name: 5c_HEE152_20130301_01.dept.fid phc0: -302.325104158 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532776682 spectralWidth: 248.6751169628855 numberOfPoints: 32768 frequencyOffset: 11058.417999990412 originFrequency: 100.5438351

Chemical Information

molecular Image
InChI InChI=1S/C17H30O2/c1-2-3-4-5-6-7-8-9-10-11-13-16(18)17-14-12-15-19-17/h12,14-16,18H,2-11,13H2,1H3
SMILES CCCCCCCCCCCCC(O)C1=CC=CO1
InChI Key KWSOXPPLWZODNZ-UHFFFAOYSA-N
Molecular Formula C17H30O2
Exact Mass 266.400 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p57.s364.d1910
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1910
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
MetadataPublished 2024-01-19 09:20:10
Related Molecule
  • 1-(furan-2-yl)tridecan-1-ol
    • Field Value
    Measurement Technique
    Measurement Variables
    NMR solvent : cdcl3

    acquisition nucleus : 13C

    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 : 248.6751169628855

    number of data points : 32768 points

    relaxation time measurement : seconds

    Data-Source Molecule ID Data-Source
    15721351 pubchem
    The data in this table is sourced from UniChem at EBI.