Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR)
Chemical Info
InChI | InChI=1S/C7H7BrO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3 |
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SMILES | COc1ccccc1Br |
InChI Key | HTDQSWDEWGSAMN-UHFFFAOYSA-N |
Molecular Formula | C7H7BrO |
Exact Mass | 187.034 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/HTDQSWDEWGSAMN-UHFFFAOYSA-N/CHMO0000593 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/HTDQSWDEWGSAMN-UHFFFAOYSA-N/CHMO0000593 |
Version | |
Author | Alex Johnson |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T04:14:43.009486 |
MetadataModified | 2024-09-08T04:14:43.009492 |
MetadataPublished | 2024-07-17 |
Field | Value |
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Measurement Technique | 1H nuclear magnetic resonance spectroscopy |
Measurement Variables |