Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C23H20O5/c1-25-18-8-10-19(11-9-18)27-20-12-14-21(15-13-20)28-22-6-4-3-5-17(22)7-16-23(24)26-2/h3-16H,1-2H3/b16-7+
SMILES	COC(=O)/C=C/c1ccccc1Oc1ccc(cc1)Oc1ccc(cc1)OC
InChI Key	MBVBREYLQZANMZ-FRKPEAEDSA-N
Molecular Formula	C23H20O5
Exact Mass	376.402 g/mol

Data and Resources

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Metadata Information

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• Molecule Data-Sources

Field	Value
DOI	10.14272/MBVBREYLQZANMZ-FRKPEAEDSA-N/NMR/1H/CDCl3/400
License URL
Source	https://www.chemotion-repository.net/inchikey/MBVBREYLQZANMZ-FRKPEAEDSA-N/NMR/1H/CDCl3/400
Version
Author	Nicole Jung
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T23:48:50.317641
MetadataModified	2024-09-07T13:09:23.892479
MetadataPublished	2014-05-27

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
73427465	PubChem
The data in this table is sourced from UniChem at EBI.