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N-[2-(methoxycarbonyl)-4,4,4-trifluoro-1-(2,2,2-trifluoroethyl)butyl]-N'-phenylurea
SpectraBase Compound ID GgNIlCt9hhA
InChI InChI=1S/C15H16F6N2O3/c1-26-12(24)10(7-14(16,17)18)11(8-15(19,20)21)23-13(25)22-9-5-3-2-4-6-9/h2-6,10-11H,7-8H2,1H3,(H2,22,23,25)
InChIKey IGQFQCMGPCXILX-UHFFFAOYSA-N
Mol Weight 386.29 g/mol
Molecular Formula C15H16F6N2O3
Exact Mass 386.106511 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDsRbxDusty
Name N-[2-(methoxycarbonyl)-4,4,4-trifluoro-1-(2,2,2-trifluoroethyl)butyl]-N'-phenylurea
Alternate Name(s) Methyl 3-[(anilinocarbonyl)amino]-5,5,5-trifluoro-2-(2,2,2-trifluoroethyl)pentanoate
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Formula C15H16F6N2O3
InChI InChI=1S/C15H16F6N2O3/c1-26-12(24)10(7-14(16,17)18)11(8-15(19,20)21)23-13(25)22-9-5-3-2-4-6-9/h2-6,10-11H,7-8H2,1H3,(H2,22,23,25)
InChIKey IGQFQCMGPCXILX-UHFFFAOYSA-N
Molecular Weight 386.294 g/mol
SMILES N(C(Nc1ccccc1)=O)C(C(C(=O)OC)CC(F)(F)F)CC(F)(F)F
SPLASH splash10-01p6-8409000000-274edb78f3c37ef9e0f9
Source of Spectrum J-54-876-11
Wiley ID 1362412