Dataset
heteronuclear multiple bond coherence (HMBC)
Chemical Info
InChI | InChI=1S/C23H20N6O3/c1-3-32-23(30)20-14-28(13-17-6-4-5-16(11-17)12-24)26-22(20)29-15-21(25-27-29)18-7-9-19(31-2)10-8-18/h4-11,14-15H,3,13H2,1-2H3 |
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SMILES | CCOC(=O)c1cn(nc1n1nnc(c1)c1ccc(cc1)OC)Cc1cccc(c1)C#N |
InChI Key | KJMWCYALHNEPDX-UHFFFAOYSA-N |
Molecular Formula | C23H20N6O3 |
Exact Mass | 428.443 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/KJMWCYALHNEPDX-UHFFFAOYSA-N/CHMO0000601 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/KJMWCYALHNEPDX-UHFFFAOYSA-N/CHMO0000601 |
Version | |
Author | Nicolai Wippert |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T02:37:22.486198 |
MetadataModified | 2024-09-08T02:37:22.486203 |
MetadataPublished | 2024-02-14 |
Field | Value |
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Measurement Technique | heteronuclear multiple bond coherence |
Measurement Variables |