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8,15-DI-O-TRICHLOROACETYLCARBAMOYLUROSPERMAL A FROM UROSPERMUMDELECHAMPII
SpectraBase Compound ID 3tkoB7Y35Sp
InChI InChI=1S/C21H18Cl6N2O9/c1-9-14-12(37-15(9)31)6-11(8-36-18(34)28-16(32)20(22,23)24)4-2-3-10(7-30)5-13(14)38-19(35)29-17(33)21(25,26)27/h3,6-7,12-14H,1-2,4-5,8H2,(H,28,32,34)(H,29,33,35)/b10-3+,11-6-/t12-,13+,14+/m0/s1
InChIKey BUNLDYGTIWNNNQ-SLQKEEQISA-N
Mol Weight 655.1 g/mol
Molecular Formula C21H18Cl6N2O9
Exact Mass 651.914346 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GcjwEawNnRl
Name 8,15-DI-O-TRICHLOROACETYLCARBAMOYLUROSPERMAL A FROM UROSPERMUMDELECHAMPII
Comments #O
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Formula C21H18Cl6N2O9
InChI InChI=1S/C21H18Cl6N2O9/c1-9-14-12(37-15(9)31)6-11(8-36-18(34)28-16(32)20(22,23)24)4-2-3-10(7-30)5-13(14)38-19(35)29-17(33)21(25,26)27/h3,6-7,12-14H,1-2,4-5,8H2,(H,28,32,34)(H,29,33,35)/b10-3+,11-6-/t12-,13+,14+/m0/s1
InChIKey BUNLDYGTIWNNNQ-SLQKEEQISA-N
Instrument Name Varian XL-200
Literature Reference U.RYCHLEWSKA, D.J.HODGSON, H.GRABARCZYK, B.DROZDZ, W.M.DANIEWSKI, W.KROSCZYNSKI,M.BUDESINSKY, M.HOLUB (1986) Coll.Czech.Chem.Comm.: v.51, N8, 1698-1709.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d