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1,3-Diethyl 2-(1,1,1,3,3,3-hexafluoro-2-{[(5-fluoro-2-methylphenyl)carbamoyl]amino}propan-2-yl)propanedioate
SpectraBase Compound ID 1eQPRxJjddF
InChI InChI=1S/C18H19F7N2O5/c1-4-31-13(28)12(14(29)32-5-2)16(17(20,21)22,18(23,24)25)27-15(30)26-11-8-10(19)7-6-9(11)3/h6-8,12H,4-5H2,1-3H3,(H2,26,27,30)
InChIKey LGBRGUMYMYDGAE-UHFFFAOYSA-N
Mol Weight 476.35 g/mol
Molecular Formula C18H19F7N2O5
Exact Mass 476.118219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3acZs3leI5C
Name 1,3-Diethyl 2-(1,1,1,3,3,3-hexafluoro-2-{[(5-fluoro-2-methylphenyl)carbamoyl]amino}propan-2-yl)propanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19F7N2O5
InChI InChI=1S/C18H19F7N2O5/c1-4-31-13(28)12(14(29)32-5-2)16(17(20,21)22,18(23,24)25)27-15(30)26-11-8-10(19)7-6-9(11)3/h6-8,12H,4-5H2,1-3H3,(H2,26,27,30)
InChIKey LGBRGUMYMYDGAE-UHFFFAOYSA-N
Molecular Weight 476.348 g/mol
SMILES N(C(C(F)(F)F)(C(F)(F)F)C(C(OCC)=O)C(OCC)=O)C(=O)Nc1c(ccc(c1)F)C
SPLASH splash10-004i-2924300000-8ce86a4db9908a14bb06
Source of Spectrum IY-2-5051-8
Synonyms Propanedioic acid, 2-[2,2,2-trifluoro-1-[[[(5-fluoro-2-methylphenyl)amino]carbonyl]amino]-1-(trifluoromethyl)ethyl]-, diethyl ester 2-[1,1,1,3,3,3-hexafluoro-2-[[(5-fluoro-2-methylanilino)-oxomethyl]amino]propan-2-yl]propanedioic acid diethyl ester Diethyl 2-[1,1,1,3,3,3-hexafluoro-2-[(5-fluoro-2-methylphenyl)carbamoylamino]propan-2-yl]propanedioate Diethyl 2-[2,2,2-trifluoro-1-[(5-fluoro-2-methyl-phenyl)carbamoylamino]-1-(trifluoromethyl)ethyl]propanedioate Diethyl 2-[1,1,1,3,3,3-hexakis(fluoranyl)-2-[(5-fluoranyl-2-methyl-phenyl)carbamoylamino]propan-2-yl]propanedioate
Wiley ID 1658501