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1-([N-(TERT.-BUTYLOXYCARBONYL)-4-[BIS-(2-CHLOROETHYL)-AMINO]-L-PHENYLALANYL]-AMINO)-3-(DIMETHYLAMINO)-PROPANE
SpectraBase Compound ID h2KyA8HZlY
InChI InChI=1S/C23H38Cl2N4O3/c1-23(2,3)32-22(31)27-20(21(30)26-13-6-14-28(4)5)17-18-7-9-19(10-8-18)29(15-11-24)16-12-25/h7-10,20H,6,11-17H2,1-5H3,(H,26,30)(H,27,31)/t20-/m1/s1
InChIKey ZBAYXRVBUCVCAI-HXUWFJFHSA-N
Mol Weight 489.5 g/mol
Molecular Formula C23H38Cl2N4O3
Exact Mass 488.232096 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID APdMPB967pf
Name 1-([N-(TERT.-BUTYLOXYCARBONYL)-4-[BIS-(2-CHLOROETHYL)-AMINO]-L-PHENYLALANYL]-AMINO)-3-(DIMETHYLAMINO)-PROPANE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H38Cl2N4O3
InChI InChI=1S/C23H38Cl2N4O3/c1-23(2,3)32-22(31)27-20(21(30)26-13-6-14-28(4)5)17-18-7-9-19(10-8-18)29(15-11-24)16-12-25/h7-10,20H,6,11-17H2,1-5H3,(H,26,30)(H,27,31)/t20-/m1/s1
InChIKey ZBAYXRVBUCVCAI-HXUWFJFHSA-N
Literature Reference Author I.GIRAUD,M.RAPP,J.C.MAURIZIS,J.C.MADELMONT
Literature Reference Citation J.MED.CHEM.,45,2116(2002)
Literature Reference DOI 10.1021/jm010926x
Molecular Weight 489.486 g/mol
Sample ID 64374
Solvent CDCl3