Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR) ()

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

Chemical Info

molecular Image
InChI InChI=1S/C13H22O3/c1-2-3-4-5-6-7-8-12-11(14)9-10-13(15)16-12/h9-10,12-13,15H,2-8H2,1H3/t12-,13?/m0/s1
SMILES CCCCCCCC[C@@H]1OC(O)C=CC1=O
InChI Key IWXIQYYOEMWJQO-UEWDXFNNSA-N
Molecular Formula C13H22O3
Exact Mass 226.316 g/mol

Data and Resources

Related Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source
Version
Author Ditfe, Toni
Maintainer chemotion.net
Language en
MetadataCreated 2023-04-03T12:57:18.506573
MetadataModified 2023-04-03T12:57:18.506578
MetadataPublished
Field Value
Measurement Technique
Measurement Variables