Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

Chemical Info

InChI	InChI=1S/C11H7N3O3/c15-10-5-2-1-3-7-8(5)6(4-12-7)9(11(16)17)13-14-10/h1-4,12H,(H,14,15)(H,16,17)
SMILES	OC(=O)C1=NNC(=O)c2c3c1c[nH]c3ccc2
InChI Key	DRRJDSUMVPRFOC-UHFFFAOYSA-N
Molecular Formula	C11H7N3O3
Exact Mass	229.192 g/mol

Data and Resources

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Metadata Information

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• Measurement
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Field	Value
DOI	10.14272/DRRJDSUMVPRFOC-UHFFFAOYSA-N/CHMO0001148.1
License URL
Source	https://www.chemotion-repository.net/inchikey/DRRJDSUMVPRFOC-UHFFFAOYSA-N/CHMO0001148.1
Version
Author	Andreas Link
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-01-29T10:07:19.119841
MetadataModified	2025-01-29T16:01:03.061932
MetadataPublished	2024-10-14
Related Molecule

Field	Value
Measurement Technique	1H–13C heteronuclear multiple bond coherence
Measurement Variables	temperature : 298.4 K PULPROG : hmbcgpndqf number of scans : 8 scans title : FP date : 20210505 starting time : 17.01 instrument : spect label : CWG-139 id : 112058 Solvent : DMSO

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.