Dataset
Rebemide; LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
Chemical Information
| InChI | InChI=1S/C11H15NO/c1-3-12(4-2)11(13)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3 |
|---|---|
| SMILES | CCN(CC)C(=O)c(c1)cccc1 |
| InChI Key | JLNGEXDJAQASHD-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO |
| Exact Mass | 177.115 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-nc/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00399 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEBI:180965 | chebi |
| 72112 | surechembl |
| 15542 | pubchem |
| 3Y74433ZXI | fdasrs |
| Molport-001-797-356 | molport |
| The data in this table is sourced from UniChem at EBI. | |