Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Info
InChI | InChI=1S/C11H10N2O/c12-5-1-6-13-7-4-9-2-3-10(14)8-11(9)13/h2-4,7-8,14H,1,6H2 |
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SMILES | N#CCCn1ccc2c1cc(O)cc2 |
InChI Key | PQNNNQZTTCGUHF-UHFFFAOYSA-N |
Molecular Formula | C11H10N2O |
Exact Mass | 186.210 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/PQNNNQZTTCGUHF-UHFFFAOYSA-N/CHMO0001146 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/PQNNNQZTTCGUHF-UHFFFAOYSA-N/CHMO0001146 |
Version | |
Author | Niklas Krappel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:24:56.383665 |
MetadataModified | 2024-09-08T01:24:56.383670 |
MetadataPublished | 2023-07-31 |
Field | Value |
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Measurement Technique | 1H–13C heteronuclear single quantum coherence |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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168433102 | PubChem |
The data in this table is sourced from UniChem at EBI. |