Dataset

heteronuclear single quantum coherence (HSQC)

Chemical Info

InChI	InChI=1S/C21H19N5O2/c1-2-28-21(27)18-14-25(13-16-9-5-3-6-10-16)23-20(18)26-15-19(22-24-26)17-11-7-4-8-12-17/h3-12,14-15H,2,13H2,1H3
SMILES	CCOC(=O)c1cn(nc1n1nnc(c1)c1ccccc1)Cc1ccccc1
InChI Key	BFHMQIVAONQIIQ-UHFFFAOYSA-N
Molecular Formula	C21H19N5O2
Exact Mass	373.408 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/BFHMQIVAONQIIQ-UHFFFAOYSA-N/CHMO0000604
License URL
Source	https://www.chemotion-repository.net/inchikey/BFHMQIVAONQIIQ-UHFFFAOYSA-N/CHMO0000604
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:59:28.910114
MetadataModified	2024-09-08T02:59:28.910121
MetadataPublished	2024-02-14

Field	Value
Measurement Technique	heteronuclear single quantum coherence
Measurement Variables

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