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/C17H22O8/c18-16-13-17(19)25-12-8-21-6-10-23-15-4-2-1-3-14(15)22-9-5-20-7-11-24-16/h1-4H,5-13H2
SMILES O=C1OCCOCCOc2ccccc2OCCOCCOC(=O)C1
InChI Key YYWXZDMWPQSJKL-UHFFFAOYSA-N
Molecular Formula C17H22O8
Exact Mass 354.352 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YYWXZDMWPQSJKL-UHFFFAOYSA-N/NMR/1H/CDCl3/300
License URL
Source https://www.chemotion-repository.net/inchikey/YYWXZDMWPQSJKL-UHFFFAOYSA-N/NMR/1H/CDCl3/300
Version
Author Sylvain Grosjean
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T22:40:44.734855
MetadataModified 2024-09-07T12:03:08.622287
MetadataPublished 2014-05-27
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
73427280 PubChem
The data in this table is sourced from UniChem at EBI.