Dataset
heteronuclear single quantum coherence (HSQC)
Chemical Info
InChI | InChI=1S/C14H9NO2/c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16/h1-7H,15H2 |
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SMILES | Nc1cccc2c1C(=O)c1ccccc1C2=O |
InChI Key | KHUFHLFHOQVFGB-UHFFFAOYSA-N |
Exact Mass | 223.227 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/KHUFHLFHOQVFGB-UHFFFAOYSA-N/CHMO0000604 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/KHUFHLFHOQVFGB-UHFFFAOYSA-N/CHMO0000604 |
Version | |
Author | Fabian Schönle |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T04:34:13.082681 |
MetadataModified | 2024-09-23T09:26:46.353728 |
MetadataPublished | 2024-08-28 |
Related Molecule |