Dataset
electrospray ionisation quadrupole detection (ESI Q Trap)
Chemical Info
InChI | InChI=1S/C20H20O3/c1-4-23-20(22)17-12-10-15(11-13-17)18(14(2)3)19(21)16-8-6-5-7-9-16/h5-13H,4H2,1-3H3 |
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SMILES | CCOC(=O)c1ccc(cc1)C(=C(C)C)C(=O)c1ccccc1 |
InChI Key | IAXLQXMTBZSTDT-UHFFFAOYSA-N |
Molecular Formula | C20H20O3 |
Exact Mass | 308.371 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/IAXLQXMTBZSTDT-UHFFFAOYSA-N/CHMO0002337 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/IAXLQXMTBZSTDT-UHFFFAOYSA-N/CHMO0002337 |
Version | |
Author | Daniel Knoll |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T01:53:42.977073 |
MetadataModified | 2024-09-07T16:16:03.254141 |
MetadataPublished | 2019-12-20 |
Field | Value |
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Measurement Technique | electrospray ionisation quadrupole detection |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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145707043 | PubChem |
The data in this table is sourced from UniChem at EBI. |