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Spiro[17H-cyclopenta[a]phenanthrene-17,2'(5'H)-furan], pregna-4,6-diene-21-carboxylic acid deriv.
SpectraBase Compound ID FKnvOuaTtBg
InChI InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3
InChIKey UJVLDDZCTMKXJK-UHFFFAOYSA-N
Mol Weight 340.46 g/mol
Molecular Formula C22H28O3
Exact Mass 340.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSijGrqteWi
Name Canrenone
CAS Registry Number 976-71-6
Classification Pharmaceutical drug, antihypertensive, diuretic, antiandrogenic
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 340.203844759 u
Formula C22H28O3
InChI InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3
InChIKey UJVLDDZCTMKXJK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 340.463 g/mol
Nominal Mass 340 u
Quality 951
Retention Index 2610
SMILES C12(C3(CCC2C2C(C4(C(C=C2)=CC(CC4)=O)C)CC1)OC(CC3)=O)C
SPLASH splash10-05mo-7931000000-4584063a5609a48e4797
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Aldadiene Phanurane Spironolactone-M (8R,9S,10R,13S,14S,17R)-10,13-Dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-\rcyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione
Technique GC/MS
Wiley ID DD2024_000427