Dataset

8-hydroxy Mirtazapine

This MassBank record with Accession MSBNK-Athens_Univ-AU155505 contains the MS2 mass spectrum of 8-hydroxy Mirtazapine with the InChIkey DAWYIZBOUQIVNX-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H19N3O/c1-19-6-7-20-16(11-19)15-5-3-2-4-12(15)8-13-9-14(21)10-18-17(13)20/h2-5,9-10,16,21H,6-8,11H2,1H3
SMILES CN1CCN2C(C1)C1=CC=CC=C1CC1=CC(O)=CN=C21
InChI Key DAWYIZBOUQIVNX-UHFFFAOYSA-N
Molecular Formula C17H19N3O
Exact Mass 281.153 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU155505
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:43:28.973367
MetadataModified 2024-01-11T09:43:29.135230
MetadataPublished 2015-12-07
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
11500131 PubChem
J2.243.321K Nikkaji
LZE1T7L9SL FDA SRS
PD164042 ProbesDrugs
26948224 eMolecules
16602053 PubChem: Thomson Pharma
HMDB0060957 Human Metabolome Database
CB1149753 ChemicalBook
DTXSID60467650 EPA CompTox Dashboard
The data in this table is sourced from UniChem at EBI.