Dataset

7c_Varian.

This dataset contains NMR spectra obtained for the sample -7c_Varian name: 7c_HEE241_20131129_03.13C.fid phc0: 139.702266527 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532777242 spectralWidth: 248.67511557768492 numberOfPoints: 32768 frequencyOffset: 11057.85800000092 originFrequency: 100.5438351 name: 7c_HEE241_20131129_03.1H.fid phc0: 7.72640919095 isFid: true nucleus: 1H solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 399.811876326 spectralWidth: 17.968220734199402 numberOfPoints: 16384 frequencyOffset: 2799.573999993754 originFrequency: 399.8146759 name: 7c_HEE241_20131129_03.dept.fid phc0: -312.833695652 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.532777242 spectralWidth: 248.67511557768492 numberOfPoints: 32768 frequencyOffset: 11057.85800000092 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-/m0/s1
SMILES CCCCCCCCCCCC[C@H](O)C1=CC=CO1
InChI Key KWSOXPPLWZODNZ-INIZCTEOSA-N
Molecular Formula C17H30O2
Exact Mass 266.400 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p57.s349.d1881
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1881
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
  • (1S)-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 : 248.67511557768492

    number of data points : 32768 points

    relaxation time measurement : seconds

    Data-Source Molecule ID Data-Source
    15721352 PubChem
    The data in this table is sourced from UniChem at EBI.