Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C12H12BrNO/c13-10-5-9-3-4-14-11(9)6-12(10)15-7-8-1-2-8/h3-6,8,14H,1-2,7H2 |
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SMILES | Brc1cc2cc[nH]c2cc1OCC1CC1 |
InChI Key | KIRAXAMYQAXCQC-UHFFFAOYSA-N |
Molecular Formula | C12H12BrNO |
Exact Mass | 266.134 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/KIRAXAMYQAXCQC-UHFFFAOYSA-N/CHMO0000595 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/KIRAXAMYQAXCQC-UHFFFAOYSA-N/CHMO0000595 |
Version | |
Author | Niklas Krappel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:14:12.798612 |
MetadataModified | 2024-09-08T01:14:12.798617 |
MetadataPublished | 2023-07-31 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |