Dataset
heteronuclear single quantum coherence (HSQC)
Chemical Info
InChI | InChI=1S/C19H16N6O3/c1-13-11-19(21-24(13)15-5-7-16(8-6-15)25(26)27)23-12-18(20-22-23)14-3-9-17(28-2)10-4-14/h3-12H,1-2H3 |
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SMILES | COc1ccc(cc1)c1nnn(c1)c1cc(n(n1)c1ccc(cc1)[N+](=O)[O-])C |
InChI Key | IZEQOYLPBRFYRC-UHFFFAOYSA-N |
Molecular Formula | C19H16N6O3 |
Exact Mass | 376.369 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/IZEQOYLPBRFYRC-UHFFFAOYSA-N/CHMO0000604 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/IZEQOYLPBRFYRC-UHFFFAOYSA-N/CHMO0000604 |
Version | |
Author | Nicolai Wippert |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T02:49:41.171328 |
MetadataModified | 2024-09-08T02:49:41.171334 |
MetadataPublished | 2024-02-14 |
Field | Value |
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Measurement Technique | heteronuclear single quantum coherence |
Measurement Variables |