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(17R)-17-ethynyl-3-methoxy-1,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
SpectraBase Compound ID Hjz0kG1tBpO
InChI InChI=1S/C22H28O2/c1-5-22(23)11-9-19-17-7-6-15-13-16(24-4)12-14(2)20(15)18(17)8-10-21(19,22)3/h1,12-13,17-19,23H,6-11H2,2-4H3/t17?,18?,19?,21?,22-/m0/s1
InChIKey SDXFYMDYTAJWRS-KMXFLUGXSA-N
Mol Weight 324.46 g/mol
Molecular Formula C22H28O2
Exact Mass 324.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Sw24brvEG
Name (17R)-17-ethynyl-3-methoxy-1,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O2
InChI InChI=1S/C22H28O2/c1-5-22(23)11-9-19-17-7-6-15-13-16(24-4)12-14(2)20(15)18(17)8-10-21(19,22)3/h1,12-13,17-19,23H,6-11H2,2-4H3/t17?,18?,19?,21?,22-/m0/s1
InChIKey SDXFYMDYTAJWRS-KMXFLUGXSA-N
Molecular Weight 324.464 g/mol
SMILES O[C@@]1(C2(C(C3CCc4c(C3CC2)c(cc(OC)c4)C)CC1)C)C#C
SPLASH splash10-00du-1951000000-73a6e9148538d4c1f6de
Source of Spectrum AD-0-2532-0
Wiley ID 1431477