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(E)-1-[(1R,2R,4R,5S)-2-hydroxy-4,5-di(thiophen-3-yl)-2-[(E)-2-thiophen-3-ylethenyl]cyclopentyl]-3-thiophen-3-ylprop-2-en-1-one
SpectraBase Compound ID 7iSG1GLtvrR
InChI InChI=1S/C26H22O2S4/c27-23(2-1-18-4-9-29-14-18)25-24(21-7-12-32-17-21)22(20-6-11-31-16-20)13-26(25,28)8-3-19-5-10-30-15-19/h1-12,14-17,22,24-25,28H,13H2/b2-1+,8-3+/t22-,24-,25+,26-/m0/s1
InChIKey QMFGXQLNCOSYDU-IOPZOETRSA-N
Mol Weight 494.7 g/mol
Molecular Formula C26H22O2S4
Exact Mass 494.050265 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8CwQ1Zt3kY
Name (E)-1-[(1R,2R,4R,5S)-2-hydroxy-4,5-di(thiophen-3-yl)-2-[(E)-2-thiophen-3-ylethenyl]cyclopentyl]-3-thiophen-3-ylprop-2-en-1-one
Compound Number 4
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H22O2S4
InChI InChI=1S/C26H22O2S4/c27-23(2-1-18-4-9-29-14-18)25-24(21-7-12-32-17-21)22(20-6-11-31-16-20)13-26(25,28)8-3-19-5-10-30-15-19/h1-12,14-17,22,24-25,28H,13H2/b2-1+,8-3+/t22-,24-,25+,26-/m0/s1
InChIKey QMFGXQLNCOSYDU-IOPZOETRSA-N
Literature Reference Author R.L.LAGADEC,M.I.CHAVEZ,L.RUBIO,A.CABRERA
Literature Reference Citation MAGN.RES.CHEM.,39,215(2001)
Literature Reference DOI 10.1002/mrc.823
Molecular Weight 494.699 g/mol
Solvent ACETONE-D6
Source File Reference UWSI24886