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Cortexolone

View entire compound with spectra: 8 NMR, 5 FTIR, 2 Raman, 1 UV-Vis, and 5 MS (GC)

Cortexolone
SpectraBase Compound ID 9XEqjkz6SQo
InChI InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1
InChIKey WHBHBVVOGNECLV-OBQKJFGGSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2XUOYgkwgR1
Name Cortexolone
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1
InChIKey WHBHBVVOGNECLV-OBQKJFGGSA-N
Melting Point 208C (dec.)
Molecular Weight 346.47
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms REICHSTEINS SUBSTANCE S CORTEXOLONE PREGN-4-ENE-3,20-DIONE, 17,21-DIHYDROXY-,