Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C9H8O4/c1-6(10)13-8-4-2-7(3-5-8)9(11)12/h2-5H,1H3,(H,11,12)
SMILES	CC(=O)Oc1ccc(cc1)C(=O)O
InChI Key	GDBUZIKSJGRBJP-UHFFFAOYSA-N
Molecular Formula	C9H8O4
Exact Mass	180.157 g/mol

Data and Resources

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Metadata Information

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• Measurement

Field	Value
DOI	10.14272/GDBUZIKSJGRBJP-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/GDBUZIKSJGRBJP-UHFFFAOYSA-N/CHMO0000593
Version
Author	Grace Hunt
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:24:58.151416
MetadataModified	2024-09-08T04:24:58.151422
MetadataPublished	2024-08-07

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