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Methyl 5-Iodo-3-[4-(N-Diethylhydrazo)-2,3,5,6-tetrafluorobenzamido]benzoate
SpectraBase Compound ID 4xTMePkd4tP
InChI InChI=1S/C19H18F4IN3O3/c1-4-27(5-2)26-17-15(22)13(20)12(14(21)16(17)23)18(28)25-11-7-9(19(29)30-3)6-10(24)8-11/h6-8,26H,4-5H2,1-3H3,(H,25,28)
InChIKey KVSFJZGXOYZKHX-UHFFFAOYSA-N
Mol Weight 539.27 g/mol
Molecular Formula C19H18F4IN3O3
Exact Mass 539.032899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nxn6vRGijF
Name Methyl 5-Iodo-3-[4-(N-Diethylhydrazo)-2,3,5,6-tetrafluorobenzamido]benzoate
Alternate Name(s) methyl 3-{[4-(2,2-diethylhydrazino)-2,3,5,6-tetrafluorobenzoyl]amino}-5-iodobenzoate Methyl 5-iodo-3-[4-(n-diethylhydrazo)-2,3,5,6-tetrafluorobenamido]benzoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18F4IN3O3
InChI InChI=1S/C19H18F4IN3O3/c1-4-27(5-2)26-17-15(22)13(20)12(14(21)16(17)23)18(28)25-11-7-9(19(29)30-3)6-10(24)8-11/h6-8,26H,4-5H2,1-3H3,(H,25,28)
InChIKey KVSFJZGXOYZKHX-UHFFFAOYSA-N
Molecular Weight 539.269 g/mol
SMILES N(C(c1c(c(c(c(c1F)F)NN(CC)CC)F)F)=O)c1cc(C(=O)OC)cc(c1)I
SPLASH splash10-000i-0000090000-9291dc5d567e6a8f5d49
Source of Spectrum J-57-1304-36
Wiley ID 1404439