Dataset

Benz[c]acridine

This MassBank record with Accession MSBNK-UFZ-UA001001 contains the MS2 mass spectrum of Benz[c]acridine with the InChIkey JEGZRTMZYUDVBF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H11N/c1-3-7-14-12(5-1)9-10-17-15(14)11-13-6-2-4-8-16(13)18-17/h1-11H
SMILES c1ccc2c(c1)ccc1nc3ccccc3cc21
InChI Key JEGZRTMZYUDVBF-UHFFFAOYSA-N
Molecular Formula C17H11N
Exact Mass 229.089 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-UFZ-UA001001
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:43:15.906209
MetadataModified 2025-02-09T19:46:07.793692
MetadataPublished 2014-06-24
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C19337 KEGG Ligand
J38.204C Nikkaji
KONMUY CCDC
DTXSID9075371 EPA CompTox Dashboard
82397 ChEBI
MCULE-3058240719 Mcule
SCHEMBL297515 SureChEMBL
ZINC000003876018 ZINC
9180 PubChem
225-11-6 ACToR
12041-95-1 ACToR
D4Q8MR98LU FDA SRS
535582 eMolecules
The data in this table is sourced from UniChem at EBI.