Dataset

Promethazine (oxide); LC-ESI-Q; MS; POS; 45 V

This MassBank record with Accession MSBNK-Waters-WA002188 contains the MS mass spectrum of Promethazine (oxide) with the InChIkey PWWVAXIEGOYWEE-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C17H20N2S/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19/h4-11,13H,12H2,1-3H3
SMILES CN(C)C(C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1
InChI Key PWWVAXIEGOYWEE-UHFFFAOYSA-N
Molecular Formula C17H20N2S
Exact Mass 284.135 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-WA002188
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • N,N-dimethyl-1-phenothiazin-10-ylpropan-2-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    PROMETHAZINE DailyMed
    50017696 BindingDB
    PROMETHAZINE HYDROCHLORIDE rxnorm
    PHENERGAN rxnorm
    PROMETHAZINE rxnorm
    SOMINEX rxnorm
    PHENERGAN clinicaltrials
    PROMETHEGAN clinicaltrials
    PRONASE clinicaltrials
    PROREX clinicaltrials
    PROTHAZIN clinicaltrials
    PROMETAZIN clinicaltrials
    PROMETHAZINE clinicaltrials
    PROMETHAZINE HYDROCHLORIDE clinicaltrials
    DIPHERGAN clinicaltrials
    ZIPAN-50 clinicaltrials
    REMSED clinicaltrials
    FF28EJQ494 FDA SRS
    DTXSID7023518 EPA CompTox Dashboard
    2286 DrugCentral
    7282 Guide to Pharmacology
    J4.809G Nikkaji
    PROMETHEGAN rxnorm
    CB31178981 ChemicalBook
    CB9744071 ChemicalBook
    C07404 KEGG Ligand
    CHEMBL643 ChEMBL
    8461 ChEBI
    DB01069 DrugBank
    162812 Brenda
    HMDB0015202 Human Metabolome Database
    promethazine DailyMed
    PA451128 PharmGKB
    6584 Brenda
    SCHEMBL4700 SureChEMBL
    MCULE-8146430046 Mcule
    20209869 NMRShiftDB
    4927 PubChem
    PD009828 ProbesDrugs
    promethazine Atlas
    14848899 PubChem: Thomson Pharma
    60-87-7 ACToR
    38878-40-9 ACToR
    LSM-4440 LINCS
    975923 eMolecules
    The data in this table is sourced from UniChem at EBI.