Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C9H6BrF3/c10-8-3-1-7(2-4-8)5-6-9(11,12)13/h1-6H/b6-5- |
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SMILES | FC(/C=C\c1ccc(cc1)Br)(F)F |
InChI Key | MHLGWXXEEZEJFU-WAYWQWQTSA-N |
Molecular Formula | C9H6BrF3 |
Exact Mass | 251.043 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/MHLGWXXEEZEJFU-WAYWQWQTSA-N/Mass/EI |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/MHLGWXXEEZEJFU-WAYWQWQTSA-N/Mass/EI |
Version | |
Author | Andreas Hafner |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T23:31:42.703706 |
MetadataModified | 2024-09-07T12:43:57.335071 |
MetadataPublished | 2014-05-27 |
Field | Value |
---|---|
Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
J3.319.432C | Nikkaji |
72793507 | PubChem |
The data in this table is sourced from UniChem at EBI. |