Dataset

8c_Varian.

This dataset contains NMR spectra obtained for the sample -8c_Varian name: 8c_HEE240_20131129_02.13C.fid phc0: 141.803627346 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532776524 spectralWidth: 248.67511735371 numberOfPoints: 32768 frequencyOffset: 11058.575999996378 originFrequency: 100.5438351 name: 8c_HEE240_20131129_02.1H.fid phc0: 8.8653006349 isFid: true nucleus: 1H solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 399.811876929 spectralWidth: 17.96822070709956 numberOfPoints: 16384 frequencyOffset: 2798.971000004258 originFrequency: 399.8146759 name: 8c_HEE240_20131129_02.dept.fid phc0: -314.4 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532776524 spectralWidth: 248.67511735371 numberOfPoints: 32768 frequencyOffset: 11058.575999996378 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/t16-/m1/s1
SMILES CCCCCCCCCCCC[C@@H](O)C1=CC=CO1
InChI Key KWSOXPPLWZODNZ-MRXNPFEDSA-N
Molecular Formula C17H30O2
Exact Mass 266.400 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p57.s369.d1923
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1923
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
  • (1R)-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 : 248.67511735371

    number of data points : 32768 points

    relaxation time measurement : seconds

    Data-Source Molecule ID Data-Source
    165416632 PubChem
    The data in this table is sourced from UniChem at EBI.