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BIS-[4-(2-S)-2,3-DIAMINOPROPYL-PHENYL]-PHOSPHINIC-ACID-TRIHYDROCHLORIDE-TETRAHYDRATE
SpectraBase Compound ID ErvX60I4xP
InChI InChI=1S/C18H27N4O2P.3ClH/c19-11-15(21)9-13-1-5-17(6-2-13)25(23,24)18-7-3-14(4-8-18)10-16(22)12-20;;;/h1-8,15-16H,9-12,19-22H2,(H,23,24);3*1H/t15-,16-;;;/m1.../s1
InChIKey NIFQYCVYWNQPIW-VSBWTOFMSA-N
Mol Weight 471.8 g/mol
Molecular Formula C18H30Cl3N4O2P
Exact Mass 470.117196 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ivw7ywSRE4
Name BIS-[4-(2-S)-2,3-DIAMINOPROPYL-PHENYL]-PHOSPHINIC-ACID-TRIHYDROCHLORIDE-TETRAHYDRATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H30Cl3N4O2P
InChI InChI=1S/C18H27N4O2P.3ClH/c19-11-15(21)9-13-1-5-17(6-2-13)25(23,24)18-7-3-14(4-8-18)10-16(22)12-20;;;/h1-8,15-16H,9-12,19-22H2,(H,23,24);3*1H/t15-,16-;;;/m1.../s1
InChIKey NIFQYCVYWNQPIW-VSBWTOFMSA-N
Literature Reference Author A.W.SCHWABACHER,A.D.STEFANESCU,A.U.REHMAN
Literature Reference Citation J.ORG.CHEM.,64,1784(1999)
Literature Reference DOI 10.1021/jo9804590
Solvent D2O
Source File Reference UWSI39577