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1-(carbamoylamino)-2,5-dimethyl-4-(2,2,2-trifluoro-1-oxoethyl)-3-pyrrolecarboxylic acid methyl ester
SpectraBase Compound ID 3YpUumZXvfO
InChI InChI=1S/C11H12F3N3O4/c1-4-6(8(18)11(12,13)14)7(9(19)21-3)5(2)17(4)16-10(15)20/h1-3H3,(H3,15,16,20)
InChIKey GZTTWXCEQQCDGT-UHFFFAOYSA-N
Mol Weight 307.23 g/mol
Molecular Formula C11H12F3N3O4
Exact Mass 307.07799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMzA1hnjVje
Name 1-(carbamoylamino)-2,5-dimethyl-4-(2,2,2-trifluoro-1-oxoethyl)-3-pyrrolecarboxylic acid methyl ester
Alternate Name(s) 2,5-Dimethyl-4-(2,2,2-trifluoroacetyl)-1-ureido-pyrrole-3-carboxylic acid methyl ester Methyl 1-(aminocarbonylamino)-2,5-dimethyl-4-[2,2,2-tris(fluoranyl)ethanoyl]pyrrole-3-carboxylate Methyl 1-(carbamoylamino)-2,5-dimethyl-4-(2,2,2-trifluoroacetyl)pyrrole-3-carboxylate Methyl 2,5-dimethyl-4-(2,2,2-trifluoroacetyl)-1-ureido-pyrrole-3-carboxylate
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Formula C11H12F3N3O4
InChI InChI=1S/C11H12F3N3O4/c1-4-6(8(18)11(12,13)14)7(9(19)21-3)5(2)17(4)16-10(15)20/h1-3H3,(H3,15,16,20)
InChIKey GZTTWXCEQQCDGT-UHFFFAOYSA-N
Molecular Weight 307.229 g/mol
SMILES N([n]1c(c(c(c1C)C(C(F)(F)F)=O)C(=O)OC)C)C(=O)N
SPLASH splash10-0571-0093000000-e01599ad7ae89525d0c5
Source of Spectrum SO-0-1843-8
Wiley ID 878690