Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)

Chemical Information

molecular Image
InChI InChI=1S/C13H16O3/c1-5-6-7-9(2)11-8-12(15-4)10(3)13(14)16-11/h5-8H,1-4H3/b6-5+,9-7+
SMILES C/C=C/C=C(/c1cc(OC)c(c(=O)o1)C)\C
InChI Key RDXUWZYDNPIQRO-SBIWHPGTSA-N
Exact Mass 220.264 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RDXUWZYDNPIQRO-SBIWHPGTSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/RDXUWZYDNPIQRO-SBIWHPGTSA-N/CHMO0001150
Version
Author Eckhard Thines
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-08-11
Related Molecule
  • 6-[(2E,4E)-hexa-2,4-dien-2-yl]-4-methoxy-3-methylpyran-2-one
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    26675338 PubChem: Thomson Pharma
    16721120 PubChem
    The data in this table is sourced from UniChem at EBI.