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4,4'-(ALPHA'',OMEGA''-DIAMINOADIPINOYL)-BIS-(10-METHYL-9-THIOACRIDANONE)
SpectraBase Compound ID 7qqu7m3NYfV
InChI InChI=1S/C34H30N4O2S2/c1-37-27-17-5-3-11-21(27)33(41)23-13-9-15-25(31(23)37)35-29(39)19-7-8-20-30(40)36-26-16-10-14-24-32(26)38(2)28-18-6-4-12-22(28)34(24)42/h3-6,9-18H,7-8,19-20H2,1-2H3,(H,35,39)(H,36,40)
InChIKey UTYQZZRQPALLEG-UHFFFAOYSA-N
Mol Weight 590.8 g/mol
Molecular Formula C34H30N4O2S2
Exact Mass 590.181019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CJP8x1uo4Bj
Name 4,4'-(ALPHA'',OMEGA''-DIAMINOADIPINOYL)-BIS-(10-METHYL-9-THIOACRIDANONE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H30N4O2S2
InChI InChI=1S/C34H30N4O2S2/c1-37-27-17-5-3-11-21(27)33(41)23-13-9-15-25(31(23)37)35-29(39)19-7-8-20-30(40)36-26-16-10-14-24-32(26)38(2)28-18-6-4-12-22(28)34(24)42/h3-6,9-18H,7-8,19-20H2,1-2H3,(H,35,39)(H,36,40)
InChIKey UTYQZZRQPALLEG-UHFFFAOYSA-N
Literature Reference Author R.VIDAL,J.P.GALY,E.J.VINCENT,A.M.GALY,J.BARBE
Literature Reference Citation HETEROCYCLES,24,1419(1986)
Literature Reference DOI 10.3987/R-1986-05-1419
Molecular Weight 590.758 g/mol
Solvent CF3COOD
Source File Reference UWED8447