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MIXTURE
SpectraBase Compound ID 2yt9IbTZJFO
InChI InChI=1S/C44H74O3/c1-10-11-12-13-14-15-16-17-18-19-32(45)30-38(46)47-37-24-26-42(7)35(40(37,4)5)23-27-44(9)36(42)21-20-34-39-33(31(2)3)22-25-41(39,6)28-29-43(34,44)8/h30,33-37,39,46H,2,10-29H2,1,3-9H3/b38-30+/t33?,34?,35?,36?,37-,39?,41?,42?,43?,44?/m0/s1
InChIKey RQKHUZPAALLYEH-JNRAGPGDSA-N
Mol Weight 651.1 g/mol
Molecular Formula C44H74O3
Exact Mass 650.563796 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LLKQQeS4qPQ
Name MIXTURE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H74O3
InChI InChI=1S/C44H74O3/c1-10-11-12-13-14-15-16-17-18-19-32(45)30-38(46)47-37-24-26-42(7)35(40(37,4)5)23-27-44(9)36(42)21-20-34-39-33(31(2)3)22-25-41(39,6)28-29-43(34,44)8/h30,33-37,39,46H,2,10-29H2,1,3-9H3/b38-30+/t33?,34?,35?,36?,37-,39?,41?,42?,43?,44?/m0/s1
InChIKey RQKHUZPAALLYEH-JNRAGPGDSA-N
Literature Reference Author M.G.D.CARVALHO,C.R.X.VELLOSO,R.BRAZ-FILHO,W.F.D.COSTA
Literature Reference Citation J.BRAZ.CHEM.SOC.,12,556(2001)
Literature Reference DOI 10.1590/s0103-50532001000400020
Molecular Weight 651.070 g/mol
Solvent CDCl3
Source File Reference UWSI20507