Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C9H6BrNO2/c10-5-3-7(9(12)13)6-1-2-11-8(6)4-5/h1-4,11H,(H,12,13) |
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SMILES | Brc1cc(C(=O)O)c2c(c1)[nH]cc2 |
InChI Key | LIXZNRVUWPYCNC-UHFFFAOYSA-N |
Molecular Formula | C9H6BrNO2 |
Exact Mass | 240.053 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/LIXZNRVUWPYCNC-UHFFFAOYSA-N/CHMO0000595 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/LIXZNRVUWPYCNC-UHFFFAOYSA-N/CHMO0000595 |
Version | |
Author | Niklas Krappel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:10:39.932779 |
MetadataModified | 2024-09-08T01:10:39.932785 |
MetadataPublished | 2023-07-31 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |