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4-(4-N',N'-BIS-(2-CHLOROETHYL)-AMINO)-PHENYLBUTYLHYDRAZIDO-BETA-D-FUCOSIDE

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4-(4-N',N'-BIS-(2-CHLOROETHYL)-AMINO)-PHENYLBUTYLHYDRAZIDO-BETA-D-FUCOSIDE
SpectraBase Compound ID ERc3RrlWHmT
InChI InChI=1S/C20H31Cl2N3O5/c1-13-17(27)18(28)19(29)20(30-13)24-23-16(26)4-2-3-14-5-7-15(8-6-14)25(11-9-21)12-10-22/h5-8,13,17-20,24,27-29H,2-4,9-12H2,1H3,(H,23,26)
InChIKey GUSBTEPMAVTHRO-UHFFFAOYSA-N
Mol Weight 464.39 g/mol
Molecular Formula C20H31Cl2N3O5
Exact Mass 463.164077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AzEhVzeUfVd
Name 4-(4-N',N'-BIS-(2-CHLOROETHYL)-AMINO)-PHENYLBUTYLHYDRAZIDO-BETA-D-FUCOSIDE
Compound Number 72
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H31Cl2N3O5
InChI InChI=1S/C20H31Cl2N3O5/c1-13-17(27)18(28)19(29)20(30-13)24-23-16(26)4-2-3-14-5-7-15(8-6-14)25(11-9-21)12-10-22/h5-8,13,17-20,24,27-29H,2-4,9-12H2,1H3,(H,23,26)
InChIKey GUSBTEPMAVTHRO-UHFFFAOYSA-N
Literature Reference Author R.D.GOFF,J.S.THORSON
Literature Reference Citation J.MED.CHEM.,53,8129(2010)
Literature Reference DOI 10.1021/jm101024j
Molecular Weight 464.389 g/mol
Solvent CD3OD
Source File Reference UWMZ47176