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[3-([N-(TERT.-BUTYLOXYCARBONYL)-4-[BIS-(2-CHLOROETHYL)-AMINO]-L-PHENYLALANYL]-AMINO)-PROPYL]-3-TRIMETHYL-AMMONIUM-IODIDE
SpectraBase Compound ID 7UuQBVIRCTK
InChI InChI=1S/C24H40Cl2N4O3.HI/c1-24(2,3)33-23(32)28-21(22(31)27-14-7-17-30(4,5)6)18-19-8-10-20(11-9-19)29(15-12-25)16-13-26;/h8-11,21H,7,12-18H2,1-6H3,(H-,27,28,31,32);1H/t21-;/m1./s1
InChIKey OPCLMVYRGFIDGN-ZMBIFBSDSA-N
Mol Weight 631.4 g/mol
Molecular Formula C24H41Cl2IN4O3
Exact Mass 630.160042 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2DKE5S5p6D8
Name [3-([N-(TERT.-BUTYLOXYCARBONYL)-4-[BIS-(2-CHLOROETHYL)-AMINO]-L-PHENYLALANYL]-AMINO)-PROPYL]-3-TRIMETHYL-AMMONIUM-IODIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H41Cl2IN4O3
InChI InChI=1S/C24H40Cl2N4O3.HI/c1-24(2,3)33-23(32)28-21(22(31)27-14-7-17-30(4,5)6)18-19-8-10-20(11-9-19)29(15-12-25)16-13-26;/h8-11,21H,7,12-18H2,1-6H3,(H-,27,28,31,32);1H/t21-;/m1./s1
InChIKey OPCLMVYRGFIDGN-ZMBIFBSDSA-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 631.425 g/mol
Sample ID 64375
Solvent DMSO-D6