Dataset

8-Hydroxyloxapine

This MassBank record with Accession MSBNK-Waters-WA002143 contains the MS mass spectrum of 8-Hydroxyloxapine with the InChIkey VNJRIWXLPIYFGI-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C18H18ClN3O2/c1-21-6-8-22(9-7-21)18-14-10-12(19)2-4-16(14)24-17-5-3-13(23)11-15(17)20-18/h2-5,10-11,23H,6-9H2,1H3
SMILES CN(C4)CCN(C4)C(=N1)c(c3)c(ccc(Cl)3)Oc(c2)c(cc(O)c2)1
InChI Key VNJRIWXLPIYFGI-UHFFFAOYSA-N
Molecular Formula C18H18ClN3O2
Exact Mass 343.109 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-Waters-WA002143
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:29:27.926862
MetadataModified 2025-02-09T20:24:06.331673
MetadataPublished 2016-01-19
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
10201033 eMolecules
15496119 PubChem: Thomson Pharma
61443-77-4 ACToR
PD060513 ProbesDrugs
DTXSID80210387 EPA CompTox Dashboard
J408.855G Nikkaji
HMDB0247441 Human Metabolome Database
0Q6HMM3XRC FDA SRS
ZINC000031984004 ZINC
43655 PubChem
The data in this table is sourced from UniChem at EBI.