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N,N',N'',N'''-Tetrakis(trifluoroacetyl)arginine
SpectraBase Compound ID 6WGIFFEQWeG
InChI InChI=1S/C14H10F12N4O6/c15-11(16,17)6(33)27-4(5(31)32)2-1-3-30(9(36)14(24,25)26)10(28-7(34)12(18,19)20)29-8(35)13(21,22)23/h4H,1-3H2,(H,27,33)(H,31,32)(H,28,29,34,35)
InChIKey ZWCMJZSHRYTRNI-UHFFFAOYSA-N
Mol Weight 558.24 g/mol
Molecular Formula C14H10F12N4O6
Exact Mass 558.040872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbQIPK58yIv
Name N,N',N'',N'''-Tetrakis(trifluoroacetyl)arginine
CAS Registry Number 85985-01-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10F12N4O6
InChI InChI=1S/C14H10F12N4O6/c15-11(16,17)6(33)27-4(5(31)32)2-1-3-30(9(36)14(24,25)26)10(28-7(34)12(18,19)20)29-8(35)13(21,22)23/h4H,1-3H2,(H,27,33)(H,31,32)(H,28,29,34,35)
InChIKey ZWCMJZSHRYTRNI-UHFFFAOYSA-N
Molecular Weight 558.237 g/mol
SMILES N(C(=O)C(F)(F)F)\C(N(CCCC(C(O)=O)NC(=O)C(F)(F)F)C(=O)C(F)(F)F)=N/C(=O)C(F)(F)F
SPLASH splash10-016r-4984000000-e886ed0b89464b8a0149
Source of Spectrum W5-1989-35426-30110
Synonyms 2-[(2,2,2-trifluoro-1-oxoethyl)amino]-5-[(2,2,2-trifluoro-1-oxoethyl)-[[(2,2,2-trifluoro-1-oxoethyl)amino]-(2,2,2-trifluoro-1-oxoethyl)iminomethyl]amino]pentanoic acid 5-[[N,N'-bis(2,2,2-trifluoroacetyl)amidino]-(2,2,2-trifluoroacetyl)amino]-2-[(2,2,2-trifluoroacetyl)amino]valeric acid 5-[[N,N'-bis(2,2,2-trifluoroacetyl)carbamimidoyl]-(2,2,2-trifluoroacetyl)amino]-2-[(2,2,2-trifluoroacetyl)amino]pentanoic acid 5-[[N,N'-bis[2,2,2-tris(fluoranyl)ethanoyl]carbamimidoyl]-[2,2,2-tris(fluoranyl)ethanoyl]amino]-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoic acid
Wiley ID 1406516