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19-(3,5-dimethyl-4-isoxazolyl)-A-nor-8β,9α,10β,14α-androstane-5,17-dione

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19-(3,5-dimethyl-4-isoxazolyl)-A-nor-8β,9α,10β,14α-androstane-5,17-dione
SpectraBase Compound ID CgpBBzF3vjZ
InChI InChI=1S/C20H27NO3/c1-11-15(12(2)24-21-11)10-16-13-8-9-20(3)17(5-7-19(20)23)14(13)4-6-18(16)22/h13-14,16-17H,4-10H2,1-3H3/t13-,14+,16+,17-,20-/m0/s1
InChIKey KKGTYANRUOHFHJ-YTRSDULBSA-N
Mol Weight 329.44 g/mol
Molecular Formula C20H27NO3
Exact Mass 329.199094 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LL1dIOd2qLI
Name 19-(3,5-dimethyl-4-isoxazolyl)-A-nor-8β,9α,10β,14α-androstane-5,17-dione
Source of Sample J. W. Scott, R. Borer & G. Saucy, Hoffmann-La Roche, Inc., Nutley, New Jersey
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO3
InChI InChI=1S/C20H27NO3/c1-11-15(12(2)24-21-11)10-16-13-8-9-20(3)17(5-7-19(20)23)14(13)4-6-18(16)22/h13-14,16-17H,4-10H2,1-3H3/t13-,14+,16+,17-,20-/m0/s1
InChIKey KKGTYANRUOHFHJ-YTRSDULBSA-N
Literature Reference J. ORG. CHEM. 37, 1652(1972)
Melting Point 107-110.5C
Molecular Weight 329.440002
Optical Properties Optical Rotation= (25C) -0.76 DEG (c=1.45, CHLOROFORM)
Synonyms A-NOR-8B,9A,10B,14A-ANDROSTANE-5,17- DIONE, 19-/3,5-DIMETHYL-4-ISOXAZOLYL/-
Technique KBr WAFER