Dataset

heteronuclear multiple bond coherence (HMBC)

Chemical Info

InChI	InChI=1S/C14H10N6O2/c1-22-14(21)10-4-2-9(3-5-10)12-8-20(19-17-12)13-11(6-15)7-16-18-13/h2-5,7-8H,1H3,(H,16,18)
SMILES	COC(=O)c1ccc(cc1)c1nnn(c1)c1n[nH]cc1C#N
InChI Key	FXIYGLHLKLOXQB-UHFFFAOYSA-N
Molecular Formula	C14H10N6O2
Exact Mass	294.268 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/FXIYGLHLKLOXQB-UHFFFAOYSA-N/CHMO0000601
License URL
Source	https://www.chemotion-repository.net/inchikey/FXIYGLHLKLOXQB-UHFFFAOYSA-N/CHMO0000601
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:50:19.620310
MetadataModified	2024-09-08T02:50:19.620318
MetadataPublished	2024-02-14

Field	Value
Measurement Technique	heteronuclear multiple bond coherence
Measurement Variables

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