Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C19H26O3/c1-6-7-8-9-10-15-11-16-14(4)17(21-5)12(2)13(3)18(16)22-19(15)20/h11H,6-10H2,1-5H3
SMILES CCCCCCc1cc2c(C)c(OC)c(c(c2oc1=O)C)C
InChI Key IHWNLGXQAWTEIK-UHFFFAOYSA-N
Molecular Formula C19H26O3
Exact Mass 302.408 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IHWNLGXQAWTEIK-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/IHWNLGXQAWTEIK-UHFFFAOYSA-N/CHMO0000593
Version
Author Florian Mohr
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-03-01
Related Molecule
  • 3-hexyl-6-methoxy-5,7,8-trimethylchromen-2-one
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    138453806 PubChem
    The data in this table is sourced from UniChem at EBI.