Dataset
Rebemide
Chemical Info
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-FIO00398 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T16:35:36.959015 |
MetadataModified | 2024-01-11T16:35:37.125141 |
MetadataPublished | 2016-01-19 |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
3Y74433ZXI | FDA SRS |
180965 | ChEBI |
1696-17-9 | ACToR |
15542 | PubChem |
14818504 | PubChem: Thomson Pharma |
CB6237033 | ChemicalBook |
889469 | eMolecules |
DTXSID0051784 | EPA CompTox Dashboard |
ZINC000000394108 | ZINC |
SCHEMBL72112 | SureChEMBL |
MolPort-001-797-356 | MolPort |
20026481 | NMRShiftDB |
MCULE-8846038964 | Mcule |
J7.563I | Nikkaji |
The data in this table is sourced from UniChem at EBI. |