Dataset
heteronuclear single quantum coherence (HSQC)
Chemical Info
InChI | InChI=1S/C12H8N6/c13-6-10-7-14-16-12(10)18-8-11(15-17-18)9-4-2-1-3-5-9/h1-5,7-8H,(H,14,16) |
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SMILES | N#Cc1c[nH]nc1n1nnc(c1)c1ccccc1 |
InChI Key | VSYUPFQKDFVQCM-UHFFFAOYSA-N |
Molecular Formula | C12H8N6 |
Exact Mass | 236.232 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/VSYUPFQKDFVQCM-UHFFFAOYSA-N/CHMO0000604 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/VSYUPFQKDFVQCM-UHFFFAOYSA-N/CHMO0000604 |
Version | |
Author | Nicolai Wippert |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T02:55:53.072459 |
MetadataModified | 2024-09-08T02:55:53.072464 |
MetadataPublished | 2024-02-14 |
Field | Value |
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Measurement Technique | heteronuclear single quantum coherence |
Measurement Variables |