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L-Phenylalanine, N-[N-(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)-L-.gamma.-glutamyl]-, dimethyl ester
SpectraBase Compound ID J2fKenW1gSq
InChI InChI=1S/C20H21F7N2O6/c1-34-15(31)12(29-17(33)18(21,22)19(23,24)20(25,26)27)8-9-14(30)28-13(16(32)35-2)10-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3,(H,28,30)(H,29,33)
InChIKey YGOANSIPRWTAGX-UHFFFAOYSA-N
Mol Weight 518.38 g/mol
Molecular Formula C20H21F7N2O6
Exact Mass 518.128784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QFupHWrWgJ
Name L-Phenylalanine, N-[N-(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)-L-.gamma.-glutamyl]-, dimethyl ester
Alternate Name(s) 1-Methoxycarbonyl-1-(helptafluoropropylcarbonylamino)-3-(N-(1'-methoxycarbonyl-2'-phenyl-ethyl)-carbamoyl)-propane Methyl 5-[(1-benzyl-2-methoxy-2-oxoethyl)amino]-2-[(2,2,3,3,4,4,4-heptafluorobutanoyl)amino]-5-oxopentanoate
CAS Registry Number 106414-05-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21F7N2O6
InChI InChI=1S/C20H21F7N2O6/c1-34-15(31)12(29-17(33)18(21,22)19(23,24)20(25,26)27)8-9-14(30)28-13(16(32)35-2)10-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3,(H,28,30)(H,29,33)
InChIKey YGOANSIPRWTAGX-UHFFFAOYSA-N
Molecular Weight 518.385 g/mol
SMILES N(C(C(C(C(F)(F)F)(F)F)(F)F)=O)C(CCC(NC(C(=O)OC)Cc1ccccc1)=O)C(=O)OC
SPLASH splash10-03di-0921000000-4a6c17a2e38656c964d6
Source of Spectrum JC-382-44-0
Wiley ID 1401615