Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C22H38O10/c23-5-7-25-9-11-27-13-15-29-17-19-31-21-3-1-2-4-22(21)32-20-18-30-16-14-28-12-10-26-8-6-24/h1-4,23-24H,5-20H2
SMILES OCCOCCOCCOCCOc1ccccc1OCCOCCOCCOCCO
InChI Key MJMLOUAQFPXFQI-UHFFFAOYSA-N
Molecular Formula C22H38O10
Exact Mass 462.531 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MJMLOUAQFPXFQI-UHFFFAOYSA-N/NMR/1H/CDCl3/300
License URL
Source https://www.chemotion-repository.net/inchikey/MJMLOUAQFPXFQI-UHFFFAOYSA-N/NMR/1H/CDCl3/300
Version
Author Sylvain Grosjean
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T22:42:36.778535
MetadataModified 2024-09-07T12:06:53.589224
MetadataPublished 2014-05-27
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
15254793 PubChem
J2.388.104G Nikkaji
The data in this table is sourced from UniChem at EBI.