Dataset

heteronuclear single quantum coherence (HSQC)

Chemical Info

InChI	InChI=1S/C13H13N5O/c1-9-7-13(16-14-9)18-8-12(15-17-18)10-3-5-11(19-2)6-4-10/h3-8H,1-2H3,(H,14,16)
SMILES	COc1ccc(cc1)c1nnn(c1)c1n[nH]c(c1)C
InChI Key	WNRIJNCEJHFAPB-UHFFFAOYSA-N
Molecular Formula	C13H13N5O
Exact Mass	255.275 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/WNRIJNCEJHFAPB-UHFFFAOYSA-N/CHMO0000604
License URL
Source	https://www.chemotion-repository.net/inchikey/WNRIJNCEJHFAPB-UHFFFAOYSA-N/CHMO0000604
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T03:00:55.772968
MetadataModified	2024-09-08T03:00:55.772974
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.