Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C16H15NO4/c1-20-13-8-7-10(9-14(13)21-2)16(19)12-6-4-3-5-11(12)15(18)17-16/h3-9,19H,1-2H3,(H,17,18)
SMILES	COc1cc(ccc1OC)C1(O)NC(=O)c2c1cccc2
InChI Key	MYHTUPULZGQKPY-UHFFFAOYSA-N
Molecular Formula	C16H15NO4
Exact Mass	285.295 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/MYHTUPULZGQKPY-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/MYHTUPULZGQKPY-UHFFFAOYSA-N/CHMO0000593
Version
Author	Georg Manolikakes
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:07:13.203680
MetadataModified	2024-09-08T02:07:13.203686
MetadataPublished	2023-12-15

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

Data-Source Molecule ID	Data-Source
141527846	PubChem
The data in this table is sourced from UniChem at EBI.