Dataset

38d[38d-C.jdx]

This dataset contains NMR spectra obtained for the sample -38d date: 2022/12/16 12:21:36.000 isFt: true name: 38d-C type: NMR SPECTRUM isFid: false lastX: -517.4192138776774 title: LJC-112-11-A.2.fid firstX: 30732.580786122322 nucleus: 13C solvent: CDCl3 dataClass: XYDATA dimension: 1 isComplex: false experiment: 1d pulseSequence: zgpg30 numberOfPoints: 65536 acquisitionMode: SIMULTANEOUS (DQD) originFrequency: 125.782939 acquisitionScheme: undefined date: 2025/05/29 15:35:31.000 isFt: true name: 38d-H type: NMR SPECTRUM isFid: false lastX: -755.786538442956 title: ZL-Z538d2-a2.1.fid firstX: 8258.636538480096 nucleus: 1H solvent: CDCl3 dataClass: XYDATA dimension: 1 isComplex: false experiment: 1d pulseSequence: zg30 numberOfPoints: 65536 acquisitionMode: SIMULTANEOUS (DQD) originFrequency: 500.193751425 acquisitionScheme: undefined

Chemical Information

molecular Image
InChI InChI=1S/C21H19NO2/c1-23-21-12-11-16(14-22-21)18-13-20(15-7-3-2-4-8-15)24-19-10-6-5-9-17(18)19/h2-12,14,18,20H,13H2,1H3
SMILES COC1=NC=C(C2CC(C3=CC=CC=C3)OC3=CC=CC=C32)C=C1
InChI Key HKHVGWPOWAUBIM-UHFFFAOYSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p116.s1197.d5175
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D5175
Version
Author
Maintainer
Language english
MetadataPublished 2025-05-30T12:26:38.000000Z
Related Molecule
  • nfdi4chem-mol6055 (Unknown Molecule)
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    NMR solvent : CDCl3

    acquisition nucleus : ['13C']

    NMR spectrum by dimensionality : 1

    NMR probe :

    Temperature : K

    magnetic field strength : Tesla

    number of scans : scans

    nuclear magnetic resonance pulse sequence : zgpg30

    Spectral Width :

    number of data points : 65536 points

    relaxation time measurement : seconds

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