Dataset
Bifenazate; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M+H]+
Chemical Information
| InChI | InChI=1S/C17H20N2O3/c1-12(2)22-17(20)19-18-15-11-14(9-10-16(15)21-3)13-7-5-4-6-8-13/h4-12,18H,1-3H3,(H,19,20) |
|---|---|
| SMILES | CC(C)OC(=O)NNC1=C(C=CC(=C1)C2=CC=CC=C2)OC |
| InChI Key | VHLKTXFWDRXILV-UHFFFAOYSA-N |
| Molecular Formula | C17H20N2O3 |
| Exact Mass | 300.147 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-EQ00350603 |
| 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:38660 | chebi |
| CHEMBL1872845 | chembl |
| 26414 | surechembl |
| 29370770 | surechembl |
| 176879 | pubchem |
| 24Z9QW0505 | fdasrs |
| PD076436 | probes_and_drugs |
| Molport-027-836-166 | molport |
| The data in this table is sourced from UniChem at EBI. | |