Dataset

9_11_NMR_Methanol-d4-2.noesy

Chemical Information

molecular Image
InChI InChI=1S/C21H20O7/c1-21(2,25)17-7-11-15(28-17)8-14(23)18-19(24)12(9-27-20(11)18)10-4-5-13(22)16(6-10)26-3/h4-6,8-9,17,22-23,25H,7H2,1-3H3
SMILES COC1=CC(C2=COC3=C4CC(C(C)(C)O)OC4=CC(O)=C3C2=O)=CC=C1O
InChI Key HYVIXVFOOCXSPL-UHFFFAOYSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p55.s288.d1681
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1681
Version
Author Çiçek SS, Galarza Pérez M, Wenzel-Storjohann A, Bezerra RM, Segovia JFO, Girreser U, Kanzaki I, Tasdemir D.
Maintainer
Language english
MetadataPublished 2024-01-16 10:27:41
Related Molecule
  • nfdi4chem-mol1984 (Unknown Molecule)
    • Field Value
    Measurement Technique noesy
    Measurement Variables
    NMR solvent : DMSO

    acquisition nucleus : 1H , 1H

    NMR spectrum by dimensionality : 2

    NMR probe : Z116098_0775 (PA BBO 400S1 BBF-H-D-05 Z SP)

    Temperature : 294.9201 K

    irradiation frequency : 400.33 MHz , 400.33 MHz

    magnetic field strength : 9.40238863211055 Tesla

    number of scans : 2 scans

    nuclear magnetic resonance pulse sequence : noesygpphpp

    Spectral Width : 8.67336626511159 , 8.67336626511158

    number of data points : 19 points

    relaxation time measurement : 2.864832 seconds

    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.