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5,6-Dihydro-5-phenylseleno-6(R)-prostacyclin

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5,6-Dihydro-5-phenylseleno-6(R)-prostacyclin
SpectraBase Compound ID CZORQMwvxcj
InChI InChI=1S/C27H40O5Se/c1-3-4-6-10-20(28)16-15-19-17-23(29)27-22(19)18-24(32-27)25(13-9-14-26(30)31-2)33-21-11-7-5-8-12-21/h5,7-8,11-12,15-16,19-20,22-25,27-29H,3-4,6,9-10,13-14,17-18H2,1-2H3/b16-15+
InChIKey UQWGSGSIOMHBEQ-FOCLMDBBSA-N
Mol Weight 523.6 g/mol
Molecular Formula C27H40O5Se
Exact Mass 524.204096 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID d5jDoe5XUW
Name 5,6-Dihydro-5-phenylseleno-6(S)-prostacyclin
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H40O5Se
InChI InChI=1S/C27H40O5Se/c1-3-4-6-10-20(28)16-15-19-17-23(29)27-22(19)18-24(32-27)25(13-9-14-26(30)31-2)33-21-11-7-5-8-12-21/h5,7-8,11-12,15-16,19-20,22-25,27-29H,3-4,6,9-10,13-14,17-18H2,1-2H3/b16-15+
InChIKey UQWGSGSIOMHBEQ-FOCLMDBBSA-N
Instrument Name Jeol FX-60
Literature Reference K.C. Nicolaou, W.E. Barnette, R. Mangolda, J. Am. Chem. Soc. 103, 3481 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3