Dataset

11-alpha-Acetoxyprogesterone; LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01718 contains the MS2 mass spectrum of 11-alpha-Acetoxyprogesterone with the InChIkey IWRPVTXREVYBHT-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C23H32O4/c1-13(24)18-7-8-19-17-6-5-15-11-16(26)9-10-22(15,3)21(17)20(27-14(2)25)12-23(18,19)4/h11,17-21H,5-10,12H2,1-4H3
SMILES CC(=O)C1CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)OC(=O)C)C
InChI Key IWRPVTXREVYBHT-UHFFFAOYSA-N
Molecular Formula C23H32O4
Exact Mass 372.230 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-Washington_State_Univ-BML01718
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • (17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-11-yl) acetate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1870185 chembl
    13379614 surechembl
    162661332 pubchem
    519975 pubchem
    PD028983 probes_and_drugs
    The data in this table is sourced from UniChem at EBI.