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17,21-Dihydroxy-pregn-4-ene-3,11,20-trione acetate

View entire compound with spectra: 5 NMR, and 3 MS (GC)

17,21-Dihydroxy-pregn-4-ene-3,11,20-trione acetate
SpectraBase Compound ID IN4nBoHG6HT
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
InChIKey ITRJWOMZKQRYTA-UHFFFAOYSA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ih6UWILfYAa
Name 17,21-Dihydroxy-pregn-4-ene-3,11,20-trione acetate
CAS Registry Number 50-04-4
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
InChIKey ITRJWOMZKQRYTA-UHFFFAOYSA-N
Instrument Name Varian XL-100
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3