Dataset
![molecular Image]()
Hexadecyltrimethylammonium
Chemical Info
| InChI | InChI=1S/C19H42N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4/h5-19H2,1-4H3/q+1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC[N+](C)(C)C |
| InChI Key | RLGQACBPNDBWTB-UHFFFAOYSA-N |
| Molecular Formula | [C19H42N]+ |
| Exact Mass | 284.332 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU284301 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T10:03:56.702421 |
| MetadataModified | 2025-02-08T19:11:38.221827 |
| MetadataPublished | 2019-05-31 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 39561 | ChEBI |
| CHEMBL1183605 | ChEMBL |
| 16A | PDBe |
| CEMEBR | CCDC |
| J8.861G | Nikkaji |
| 3082 | DrugCentral |
| DTXSID3047978 | EPA CompTox Dashboard |
| MCULE-4305670420 | Mcule |
| CETRIMONIUM | clinicaltrials |
| CETRIMONIUM BROMIDE | clinicaltrials |
| CETRIMONIUM BROMIDE | rxnorm |
| CETRIMONIUM | rxnorm |
| CETRIMONIUM | DailyMed |
| 58941 | BindingDB |
| DB01718 | DrugBank |
| 2681 | PubChem |
| PD008476 | ProbesDrugs |
| 14751059 | PubChem: Thomson Pharma |
| 6899-10-1 | ACToR |
| Z7FF1XKL7A | FDA SRS |
| 1986109 | eMolecules |
| 169661 | Brenda |
| ZINC000006846023 | ZINC |
| SCHEMBL48763 | SureChEMBL |
| 20097206 | NMRShiftDB |
| The data in this table is sourced from UniChem at EBI. | |