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6E-ISOMER
SpectraBase Compound ID 8niCl5654tX
InChI InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-36-34(5)22-15-28-39(36,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-37-35(6)38(41)27-29-40(37,9)10/h11-14,16-17,19-26H,15,18,27-29H2,1-10H3/b12-11+,19-14+,20-13+,26-24+,30-16+,31-17+,32-23+,33-21+,36-25+
InChIKey GSYJZYIROSRFCV-MRSLQTCCSA-N
Mol Weight 550.9 g/mol
Molecular Formula C40H54O
Exact Mass 550.417466 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AriXB99zR3g
Name 6E-ISOMER
Compound Number 17A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H54O
InChI InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-36-34(5)22-15-28-39(36,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-37-35(6)38(41)27-29-40(37,9)10/h11-14,16-17,19-26H,15,18,27-29H2,1-10H3/b12-11+,19-14+,20-13+,26-24+,30-16+,31-17+,32-23+,33-21+,36-25+
InChIKey GSYJZYIROSRFCV-MRSLQTCCSA-N
Literature Reference Author B.F.LUTNAES,G.KILDAHL-ANDERSEN,J.KRANE,S.LIAAEN-JENSEN
Literature Reference Citation J.AM.CHEM.SOC.,126,8981(2004)
Literature Reference DOI 10.1021/ja0492541
Molecular Weight 550.868 g/mol
Solvent CD2Cl2
Source File Reference UWVN31460