Dataset

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

Chemical Info

InChI	InChI=1S/C22H22N6O/c1-3-4-7-18-14-28(27-26-18)22-21(24-19-8-5-6-9-20(19)25-22)23-17-12-10-16(11-13-17)15(2)29/h5-6,8-14H,3-4,7H2,1-2H3,(H,23,24)
SMILES	CCCCc1nnn(c1)c1nc2ccccc2nc1Nc1ccc(cc1)C(=O)C
InChI Key	WGMOCILRUYTMIW-UHFFFAOYSA-N
Molecular Formula	C22H22N6O
Exact Mass	386.450 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/WGMOCILRUYTMIW-UHFFFAOYSA-N/CHMO0001148
License URL
Source	https://www.chemotion-repository.net/inchikey/WGMOCILRUYTMIW-UHFFFAOYSA-N/CHMO0001148
Version
Author	Laura Holzhauer
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T05:57:41.736388
MetadataModified	2024-09-07T21:35:50.862281
MetadataPublished	2022-02-11

Field	Value
Measurement Technique	1H–13C heteronuclear multiple bond coherence
Measurement Variables

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