Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C9H10Br2O/c1-6(12-2)8-5-7(10)3-4-9(8)11/h3-6H,1-2H3/t6-/m0/s1 |
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SMILES | C[C@@H](c1cc(Br)ccc1Br)OC |
InChI Key | RNLYINNBMKDNJK-LURJTMIESA-N |
Molecular Formula | C9H10Br2O |
Exact Mass | 293.983 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/RNLYINNBMKDNJK-LURJTMIESA-N/CHMO0000480 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/RNLYINNBMKDNJK-LURJTMIESA-N/CHMO0000480 |
Version | |
Author | Christoph Zippel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T01:56:45.876697 |
MetadataModified | 2024-09-07T16:20:15.410022 |
MetadataPublished | 2020-01-03 |
Field | Value |
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Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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145721701 | PubChem |
The data in this table is sourced from UniChem at EBI. |