Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Info
InChI | InChI=1S/C16H20F2O4/c1-4-21-14(19)13(15(20)22-5-2)10-11-6-8-12(9-7-11)16(3,17)18/h6-9,13H,4-5,10H2,1-3H3 |
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SMILES | CCOC(=O)C(C(=O)OCC)Cc1ccc(cc1)C(F)(F)C |
InChI Key | SGXOPAFVTDWULO-UHFFFAOYSA-N |
Molecular Formula | C16H20F2O4 |
Exact Mass | 314.324 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/SGXOPAFVTDWULO-UHFFFAOYSA-N/CHMO0000480 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/SGXOPAFVTDWULO-UHFFFAOYSA-N/CHMO0000480 |
Version | |
Author | Sylvia Vanderheiden-Schroen |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T05:16:50.358342 |
MetadataModified | 2024-09-07T20:43:20.507045 |
MetadataPublished | 2021-11-26 |
Field | Value |
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Measurement Technique | electron ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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157010881 | PubChem |
The data in this table is sourced from UniChem at EBI. |