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YXMVGMRAJKBLJM-UHFFFAOYSA-N
SpectraBase Compound ID 3MwOcAniWgx
InChI InChI=1S/C33H40N6O3S/c34-15-6-5-11-25-19-39(30(32(35)41)16-24-18-36-28-14-4-3-13-27(24)28)31(40)21-43-20-29(33(42)38-25)37-17-23-10-7-9-22-8-1-2-12-26(22)23/h1-4,7-10,12-14,18,25,29-30,36-37H,5-6,11,15-17,19-21,34H2,(H2,35,41)(H,38,42)
InChIKey YXMVGMRAJKBLJM-UHFFFAOYSA-N
Mol Weight 600.8 g/mol
Molecular Formula C33H40N6O3S
Exact Mass 600.28826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4k7QEPWAElg
Name YXMVGMRAJKBLJM-UHFFFAOYSA-N
Compound Number 1P-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H40N6O3S
InChI InChI=1S/C33H40N6O3S/c34-15-6-5-11-25-19-39(30(32(35)41)16-24-18-36-28-14-4-3-13-27(24)28)31(40)21-43-20-29(33(42)38-25)37-17-23-10-7-9-22-8-1-2-12-26(22)23/h1-4,7-10,12-14,18,25,29-30,36-37H,5-6,11,15-17,19-21,34H2,(H2,35,41)(H,38,42)
InChIKey YXMVGMRAJKBLJM-UHFFFAOYSA-N
Literature Reference Author J.BONDEBJERG,Z.XIANG,R.M.BAUZO,C.HASKELL-LUEVANO,M.MELDAL
Literature Reference Citation J.AM.CHEM.SOC.,124,11046(2002)
Literature Reference DOI 10.1021/ja0123913
Molecular Weight 600.779 g/mol
Sample ID 34727
Solvent DMSO-D6