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ETHYL-PHENYLALANYLGLYCYLGLYCINE-TRIFLUOROACETATE
SpectraBase Compound ID 833HRJyXma3
InChI InChI=1S/C15H21N3O4.C2HF3O2/c1-2-22-14(20)10-17-13(19)9-18-15(21)12(16)8-11-6-4-3-5-7-11;3-2(4,5)1(6)7/h3-7,12H,2,8-10,16H2,1H3,(H,17,19)(H,18,21);(H,6,7)/t12-;/m0./s1
InChIKey ODWYSSWXZYIXID-YDALLXLXSA-N
Mol Weight 421.373 g/mol
Molecular Formula C17H22F3N3O6
Exact Mass 421.14607 g/mol
Parent InChIKey NMXJFFMSRVASBH-LBPRGKRZSA-N
Enantiomer InChIKey ODWYSSWXZYIXID-UTONKHPSSA-N
Racemate InChIKey ODWYSSWXZYIXID-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent TFA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent HCOOH
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent H2O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CH2ClCH2OH
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO
Title Journal or Book Year
15N NMR spectroscopy. 30—structure/shift relationships of oligopeptides and copolypeptides, including gramicidin S Organic Magnetic Resonance 1981

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