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2-[4-[BIS-(2-CHLOROETHYL)-AMINO]-BENZYL]-5,5-DIMETHYL-2,5-DIHYDRO-4H-BENZO-[E]-ISOINDOL-4-ONE

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2-[4-[BIS-(2-CHLOROETHYL)-AMINO]-BENZYL]-5,5-DIMETHYL-2,5-DIHYDRO-4H-BENZO-[E]-ISOINDOL-4-ONE
SpectraBase Compound ID LmRsgdsYyM3
InChI InChI=1S/C25H26Cl2N2O/c1-25(2)23-6-4-3-5-20(23)21-16-28(17-22(21)24(25)30)15-18-7-9-19(10-8-18)29(13-11-26)14-12-27/h3-10,16-17H,11-15H2,1-2H3
InChIKey UYMOOWXVOGBCAT-UHFFFAOYSA-N
Mol Weight 441.4 g/mol
Molecular Formula C25H26Cl2N2O
Exact Mass 440.142219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FT43foCEazd
Name 2-[4-[BIS-(2-CHLOROETHYL)-AMINO]-BENZYL]-5,5-DIMETHYL-2,5-DIHYDRO-4H-BENZO-[E]-ISOINDOL-4-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26Cl2N2O
InChI InChI=1S/C25H26Cl2N2O/c1-25(2)23-6-4-3-5-20(23)21-16-28(17-22(21)24(25)30)15-18-7-9-19(10-8-18)29(13-11-26)14-12-27/h3-10,16-17H,11-15H2,1-2H3
InChIKey UYMOOWXVOGBCAT-UHFFFAOYSA-N
Literature Reference Author H.SPREITZER,C.PUSCHMANN
Literature Reference Citation MOLBANK,M651(2010)
Molecular Weight 441.400 g/mol
Solvent CDCl3
Source File Reference UWLU83044