Dataset
heteronuclear multiple bond coherence (HMBC)
Chemical Info
InChI | InChI=1S/C19H14N6/c1-14-11-19(22-25(14)17-9-7-15(12-20)8-10-17)24-13-18(21-23-24)16-5-3-2-4-6-16/h2-11,13H,1H3 |
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SMILES | N#Cc1ccc(cc1)n1nc(cc1C)n1nnc(c1)c1ccccc1 |
InChI Key | QJHTUPAVPUUSNY-UHFFFAOYSA-N |
Exact Mass | 326.355 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/QJHTUPAVPUUSNY-UHFFFAOYSA-N/CHMO0000601.1 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/QJHTUPAVPUUSNY-UHFFFAOYSA-N/CHMO0000601.1 |
Version | |
Author | Simone Gräßle |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T02:20:20.346952 |
MetadataModified | 2024-09-08T02:20:20.346958 |
MetadataPublished | 2024-02-14 |
Field | Value |
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Measurement Technique | heteronuclear multiple bond coherence |
Measurement Variables |
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