Dataset
Fenpropathrin; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M+H]+
Chemical Information
| InChI | InChI=1S/C22H23NO3/c1-21(2)19(22(21,3)4)20(24)26-18(14-23)15-9-8-12-17(13-15)25-16-10-6-5-7-11-16/h5-13,18-19H,1-4H3 |
|---|---|
| SMILES | CC1(C(C1(C)C)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C |
| InChI Key | XQUXKZZNEFRCAW-UHFFFAOYSA-N |
| Molecular Formula | C22H23NO3 |
| Exact Mass | 349.168 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ00322003 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2024-06-14 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEBI:39353 | chebi |
| CHEMBL522994 | chembl |
| 26248 | surechembl |
| 29805153 | surechembl |
| 47326 | pubchem |
| 87BH96P0MX | fdasrs |
| PD150764 | probes_and_drugs |
| 233985 | brenda |
| HMDB0252216 | hmdb |
| The data in this table is sourced from UniChem at EBI. | |