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Cortisone acetate

View entire compound with spectra: 5 NMR, 6 FTIR, 1 Raman, and 2 MS (GC)

Cortisone acetate
SpectraBase Compound ID 3RtbaPeSFhG
InChI InChI=1S/C23H30O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-17,20,28H,4-9,11-12H2,1-3H3/t16-,17-,20+,21-,22-,23-/m0/s1
InChIKey ITRJWOMZKQRYTA-RFZYENFJSA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DCDUuohrs4T
Name Cortisone acetate
Source of Sample M. L. Lewbart, Crozer-Chester Medical Center, Chester, Pennsylvania
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O6
InChI InChI=1S/C23H30O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-17,20,28H,4-9,11-12H2,1-3H3/t16-,17-,20+,21-,22-,23-/m0/s1
InChIKey ITRJWOMZKQRYTA-RFZYENFJSA-N
Melting Point 240.5-243C
Molecular Weight 402.49
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PREGN-4-ENE-3,11,20-TRIONE, 17,21-DIHYDROXY-, 21-ACETATE CORTISONE, 21-ACETATE CORTICOSTERONE, 11-DEHYDRO- 17-HYDROXY-, 21-ACETATE