Dataset

Hydroxyzine

This MassBank record with Accession MSBNK-Waters-WA002928 contains the MS mass spectrum of Hydroxyzine with the InChIkey ZQDWXGKKHFNSQK-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C21H27ClN2O2/c22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-9,21,25H,10-17H2
SMILES OCCOCCN(C3)CCN(C3)C(c(c2)cccc2)c(c1)ccc(Cl)c1
InChI Key ZQDWXGKKHFNSQK-UHFFFAOYSA-N
Molecular Formula C21H27ClN2O2
Exact Mass 374.176 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-WA002928
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:48:18.749706
MetadataModified 2024-01-11T22:48:18.897554
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
1987151 eMolecules
5818 ChEBI
DB00557 DrugBank
C07045 KEGG Ligand
CHEMBL896 ChEMBL
MCULE-6995009916 Mcule
1400 DrugCentral
22875 BindingDB
HYDROXYZINE DailyMed
HYDROXYZINE HYDROCHLORIDE rxnorm
VISTARIL rxnorm
HYDROXYZINE PAMOATE rxnorm
HYDROXYZINE rxnorm
VISTARIL clinicaltrials
ATARAX clinicaltrials
ORGATRAX clinicaltrials
HYDROXYZINE clinicaltrials
HYDROXYZINE DIHYDROCHLORIDE clinicaltrials
HYDROXYZINE HYDROCHLORIDE clinicaltrials
HYDROXYZINE PAMOATE clinicaltrials
HY-B0548 MedChemExpress
30S50YM8OG FDA SRS
HMDB0014697 Human Metabolome Database
145968 Brenda
146702 Brenda
145054 Brenda
DTXSID8023137 EPA CompTox Dashboard
CB2547530 ChemicalBook
hydroxyzine DailyMed
3658 PubChem
PD009966 ProbesDrugs
hydroxyzine Atlas
14853297 PubChem: Thomson Pharma
68-88-2 ACToR
PA449943 PharmGKB
LSM-5103 LINCS
7199 Guide to Pharmacology
J4.860G Nikkaji
SCHEMBL4491 SureChEMBL
The data in this table is sourced from UniChem at EBI.