Dataset
![molecular Image]()
Acenapthylene
Chemical Info
| InChI | InChI=1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H |
|---|---|
| SMILES | C1=CC2=C3C1=CC=CC3=CC=C2 |
| InChI Key | HXGDTGSAIMULJN-UHFFFAOYSA-N |
| Molecular Formula | C12H8 |
| Exact Mass | 152.063 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-AU590218 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T10:06:47.472166 |
| MetadataModified | 2025-02-08T19:08:43.596539 |
| MetadataPublished | 2019-11-21 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CB1665589 | ChemicalBook |
| 125427 | Brenda |
| SCHEMBL26037 | SureChEMBL |
| 10016518 | NMRShiftDB |
| 9161 | PubChem |
| CHEMBL2132328 | ChEMBL |
| 15120186 | PubChem: Thomson Pharma |
| PD158308 | ProbesDrugs |
| CB1781056 | ChemicalBook |
| 1Z25C36811 | FDA SRS |
| 208-96-8 | ACToR |
| 34493-60-2 | ACToR |
| 474264 | eMolecules |
| J2.561E | Nikkaji |
| HY-W013570 | MedChemExpress |
| ACENYL | CCDC |
| HMDB0247900 | Human Metabolome Database |
| ZINC000001689804 | ZINC |
| DTXSID3023845 | EPA CompTox Dashboard |
| MCULE-4571389115 | Mcule |
| 33081 | ChEBI |
| The data in this table is sourced from UniChem at EBI. | |