Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C16H19F3/c1-15(2,3)12-8-9-13(11-6-4-5-7-11)14(10-12)16(17,18)19/h6,8-10H,4-5,7H2,1-3H3 |
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SMILES | FC(c1cc(ccc1C1=CCCC1)C(C)(C)C)(F)F |
InChI Key | FNRGVZOIYQQEEX-UHFFFAOYSA-N |
Molecular Formula | C16H19F3 |
Exact Mass | 268.317 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/FNRGVZOIYQQEEX-UHFFFAOYSA-N/Mass/EI |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/FNRGVZOIYQQEEX-UHFFFAOYSA-N/Mass/EI |
Version | |
Author | Andreas Hafner |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T23:41:31.043627 |
MetadataModified | 2024-09-07T12:58:29.374445 |
MetadataPublished | 2014-05-27 |
Field | Value |
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Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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73427450 | PubChem |
The data in this table is sourced from UniChem at EBI. |