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/C19H16O6/c1-24-19(11-15(21)12-7-9-14(20)10-8-12)16(17(22)18(23)25-19)13-5-3-2-4-6-13/h2-10,20,22H,11H2,1H3
SMILES COC1(OC(=O)C(=C1c1ccccc1)O)CC(=O)c1ccc(cc1)O
InChI Key LQKBSBWZJOHANT-UHFFFAOYSA-N
Molecular Formula C19H16O6
Exact Mass 340.327 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LQKBSBWZJOHANT-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/LQKBSBWZJOHANT-UHFFFAOYSA-N/CHMO0000593
Version
Author Anja Schueffler
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-04-06T02:03:21.519237
MetadataModified 2025-04-06T02:18:24.233103
MetadataPublished 2025-04-03
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