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2-(3-Difluoroboryl-(Z)-2-butenoyl)-3-methoxy-17b-acetoxy-estra-1,3,5(10)-triene
SpectraBase Compound ID 7rLVzYb86jV
InChI InChI=1S/C25H31BF2O5/c1-14(33-26(27)28)11-22(30)20-13-19-16(12-23(20)31-4)5-6-18-17(19)9-10-25(3)21(18)7-8-24(25)32-15(2)29/h11-13,17-18,21,24H,5-10H2,1-4H3/b14-11-
InChIKey DGOYSEJKMIJOEZ-KAMYIIQDSA-N
Mol Weight 460.3 g/mol
Molecular Formula C25H31BF2O5
Exact Mass 460.223261 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LSV4yCqZSeE
Name 2-(3-Difluoroboryl-(Z)-2-butenoyl)-3-methoxy-17b-acetoxy-estra-1,3,5(10)-triene
CAS Registry Number 84640-70-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H31BF2O5
InChI InChI=1S/C25H31BF2O5/c1-14(33-26(27)28)11-22(30)20-13-19-16(12-23(20)31-4)5-6-18-17(19)9-10-25(3)21(18)7-8-24(25)32-15(2)29/h11-13,17-18,21,24H,5-10H2,1-4H3/b14-11-
InChIKey DGOYSEJKMIJOEZ-KAMYIIQDSA-N
Literature Reference E. Santaniello, A. Fiecchi, P. Ferraboschi, J. Chem. Soc. Chem. Comm. 1157 (1982
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3