Dataset

7b_Varian.

This dataset contains NMR spectra obtained for the sample -7b_Varian name: 7b_HEE304_20140219_03.13C.fid phc0: 56.8635547576 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.53277566 spectralWidth: 248.6751194908767 numberOfPoints: 32768 frequencyOffset: 11059.439999996812 originFrequency: 100.5438351 name: 7b_HEE304_20140219_03.1H.fid phc0: -78.2761647586 isFid: true nucleus: 1H solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 399.811876894 spectralWidth: 17.968220708672522 numberOfPoints: 16384 frequencyOffset: 2799.0059999751793 originFrequency: 399.8146759 name: 7b_HEE304_20140219_03.dept.fid phc0: -33.4 isFid: true nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 100.53277566 spectralWidth: 248.6751194908767 numberOfPoints: 32768 frequencyOffset: 11059.439999996812 originFrequency: 100.5438351

Chemical Info

molecular Image
InChI InChI=1S/C15H26O2/c1-2-3-4-5-6-7-8-9-11-14(16)15-12-10-13-17-15/h10,12-14,16H,2-9,11H2,1H3/t14-/m0/s1
SMILES CCCCCCCCCC[C@H](O)C1=CC=CO1
InChI Key XDKMPPWBMLMXLH-AWEZNQCLSA-N
Molecular Formula C15H26O2
Exact Mass 238.370 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p57.s366.d1916
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1916
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
MetadataCreated 2024-05-15T09:18:38.949520
MetadataModified 2024-09-23T09:37:56.920683
MetadataPublished 2024-01-19 09:20:10
Field Value
No additional information available for this Dataset.
Data-Source Molecule ID Data-Source
14641210 PubChem
The data in this table is sourced from UniChem at EBI.