Dataset

heteronuclear single quantum coherence (HSQC)

Chemical Info

InChI	InChI=1S/C20H16N6/c1-15-7-9-16(10-8-15)12-25-13-18(11-21)20(23-25)26-14-19(22-24-26)17-5-3-2-4-6-17/h2-10,13-14H,12H2,1H3
SMILES	N#Cc1cn(nc1n1nnc(c1)c1ccccc1)Cc1ccc(cc1)C
InChI Key	ZHUFVXOCSYMTKK-UHFFFAOYSA-N
Molecular Formula	C20H16N6
Exact Mass	340.381 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/ZHUFVXOCSYMTKK-UHFFFAOYSA-N/CHMO0000604
License URL
Source	https://www.chemotion-repository.net/inchikey/ZHUFVXOCSYMTKK-UHFFFAOYSA-N/CHMO0000604
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T03:00:02.102971
MetadataModified	2024-09-08T03:00:02.102978
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.