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(4S)-(3'-AMINO)-PROPYL-9-AMINO-3,6-DIAZANONANE-TETRAKIS-(TRIFLUOROACETATIC-ACID)-SALT

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(4S)-(3'-AMINO)-PROPYL-9-AMINO-3,6-DIAZANONANE-TETRAKIS-(TRIFLUOROACETATIC-ACID)-SALT
SpectraBase Compound ID 9HKlphiK2ru
InChI InChI=1S/C10H26N4.4C2HF3O2/c1-2-14-10(5-3-6-11)9-13-8-4-7-12;4*3-2(4,5)1(6)7/h10,13-14H,2-9,11-12H2,1H3;4*(H,6,7)/t10-;;;;/m0..../s1
InChIKey OTPIOEFOFPZVLG-CZEDPBFNSA-N
Mol Weight 658.439 g/mol
Molecular Formula C18H30F12N4O8
Exact Mass 658.187202 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 53Xqyy6wuvM
Name (4S)-(3'-AMINO)-PROPYL-9-AMINO-3,6-DIAZANONANE-TETRAKIS-(TRIFLUOROACETATIC-ACID)-SALT
Compound Number 8I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H30F12N4O8
InChI InChI=1S/C10H26N4.4C2HF3O2/c1-2-14-10(5-3-6-11)9-13-8-4-7-12;4*3-2(4,5)1(6)7/h10,13-14H,2-9,11-12H2,1H3;4*(H,6,7)/t10-;;;;/m0..../s1
InChIKey OTPIOEFOFPZVLG-CZEDPBFNSA-N
Literature Reference Author S.MANKU,C.LAPLANTE,D.KOPAC,T.CHAN,D.G.HALL
Literature Reference Citation J.ORG.CHEM.,66,874(2001)
Literature Reference DOI 10.1021/jo005647g
Molecular Weight 658.439 g/mol
Solvent CD3OD
Source File Reference UWVN26152