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/C19H16O5/c1-24-16-10-15(11-2-6-13(20)7-3-11)18(22)19(23)17(16)12-4-8-14(21)9-5-12/h2-10,20-23H,1H3
SMILES COc1cc(c2ccc(cc2)O)c(c(c1c1ccc(cc1)O)O)O
InChI Key HDXIDAAYQIUQQS-UHFFFAOYSA-N
Molecular Formula C19H16O5
Exact Mass 324.327 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HDXIDAAYQIUQQS-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/HDXIDAAYQIUQQS-UHFFFAOYSA-N/CHMO0000593
Version
Author Anja Schueffler
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-04-06T02:01:26.815863
MetadataModified 2025-04-06T02:16:30.444977
MetadataPublished 2025-04-03
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