Dataset
heteronuclear multiple bond coherence (HMBC)
Chemical Info
InChI | InChI=1S/C8H11N5/c9-12-10-8-5-6-13(11-8)7-3-1-2-4-7/h5-7H,1-4H2 |
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SMILES | [N-]=[N+]=Nc1ccn(n1)C1CCCC1 |
InChI Key | CEJMUQXTWWQJBT-UHFFFAOYSA-N |
Molecular Formula | C8H11N5 |
Exact Mass | 177.206 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/CEJMUQXTWWQJBT-UHFFFAOYSA-N/CHMO0000601 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/CEJMUQXTWWQJBT-UHFFFAOYSA-N/CHMO0000601 |
Version | |
Author | Nicolai Wippert |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T02:53:54.394077 |
MetadataModified | 2024-09-08T02:53:54.394081 |
MetadataPublished | 2024-02-14 |
Field | Value |
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Measurement Technique | heteronuclear multiple bond coherence |
Measurement Variables |