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4.alpha.-(2'-Pyridylthio)-18-norpodocarpa-8,11,13-trien-12-yl benzoate
SpectraBase Compound ID GjAQaumYFae
InChI InChI=1S/C28H29NO2S/c1-27-16-8-17-28(2,32-25-11-6-7-18-29-25)24(27)15-13-20-12-14-22(19-23(20)27)31-26(30)21-9-4-3-5-10-21/h3-7,9-12,14,18-19,24H,8,13,15-17H2,1-2H3/t24-,27-,28-/m1/s1
InChIKey YIGBRPNZKUUGAJ-RYRVMRHHSA-N
Mol Weight 443.61 g/mol
Molecular Formula C28H29NO2S
Exact Mass 443.1919 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E8vPhUOPiGj
Name 4-ALPHA-(2'-PYRIDYLTHIO)-18-NORPODOCARPA-8,11,13-TRIEN-12-YL-BENZOATE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H29NO2S
InChI InChI=1S/C28H29NO2S/c1-27-16-8-17-28(2,32-25-11-6-7-18-29-25)24(27)15-13-20-12-14-22(19-23(20)27)31-26(30)21-9-4-3-5-10-21/h3-7,9-12,14,18-19,24H,8,13,15-17H2,1-2H3/t24-,27-,28-/m1/s1
InChIKey YIGBRPNZKUUGAJ-RYRVMRHHSA-N
Literature Reference Author R.C.CAMBIE,P.K.DAVY,L.H.MITCHELL,C.E.F.RICKARD,P.S.RUTLEDGE
Literature Reference Citation AUSTR.J.CHEM.,51,653(1998)
Literature Reference DOI 10.1071/C97213
Molecular Weight 443.604 g/mol
Solvent CDCl3
Source File Reference UWGE1841