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/C17H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21-17(20)16(18)19/h2-15H2,1H3,(H,18,19)
SMILES CCCCCCCCCCCCCCCOC(=O)C(=O)O
InChI Key OMJGMZAOUDJZRQ-UHFFFAOYSA-N
Molecular Formula C17H32O4
Exact Mass 300.434 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/OMJGMZAOUDJZRQ-UHFFFAOYSA-N/NMR/1H/CDCl3/400
License URL
Source https://www.chemotion-repository.net/inchikey/OMJGMZAOUDJZRQ-UHFFFAOYSA-N/NMR/1H/CDCl3/400
Version
Author Christina Belenki
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T23:50:48.701790
MetadataModified 2024-09-07T13:12:21.249667
MetadataPublished 2014-05-27
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
73427470 PubChem
The data in this table is sourced from UniChem at EBI.