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17A-[4-(4-FLUOROPHENYL)-PIPERAZIN-1-YLMETHYL]-ANDROSTA-5,7-DIEN-3B,17B-DIOL
SpectraBase Compound ID GfBBajlev4c
InChI InChI=1S/C30H41FN2O2/c1-28-12-9-24(34)19-21(28)3-8-25-26(28)10-13-29(2)27(25)11-14-30(29,35)20-32-15-17-33(18-16-32)23-6-4-22(31)5-7-23/h3-8,24,26-27,34-35H,9-20H2,1-2H3/t24-,26-,27-,28-,29-,30+/m0/s1
InChIKey RHENZJYWEZXUQX-UJJOWMEUSA-N
Mol Weight 480.7 g/mol
Molecular Formula C30H41FN2O2
Exact Mass 480.315207 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KKJrrk1Gxy
Name 17A-[4-(4-FLUOROPHENYL)-PIPERAZIN-1-YLMETHYL]-ANDROSTA-5,7-DIEN-3B,17B-DIOL
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H41FN2O2
InChI InChI=1S/C30H41FN2O2/c1-28-12-9-24(34)19-21(28)3-8-25-26(28)10-13-29(2)27(25)11-14-30(29,35)20-32-15-17-33(18-16-32)23-6-4-22(31)5-7-23/h3-8,24,26-27,34-35H,9-20H2,1-2H3/t24-,26-,27-,28-,29-,30+/m0/s1
InChIKey RHENZJYWEZXUQX-UJJOWMEUSA-N
Literature Reference Author N.KUMAR,M.KIUCHI,J.A.TALLARICO,S.L.SCHREIBER
Literature Reference Citation ORG.LETTERS,7,2535(2005)
Literature Reference DOI 10.1021/ol0504345
Molecular Weight 480.666 g/mol
Sample ID 42955
Solvent CDCl3