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Methyl 4-(3,3-dimethylureido)-3-(2,2,2-trifluoroethyl)benzoate
SpectraBase Compound ID AFQywBDMeds
InChI InChI=1S/C13H15F3N2O3/c1-18(2)12(20)17-10-5-4-8(11(19)21-3)6-9(10)7-13(14,15)16/h4-6H,7H2,1-3H3,(H,17,20)
InChIKey FEQRYHSXYXUGNC-UHFFFAOYSA-N
Mol Weight 304.27 g/mol
Molecular Formula C13H15F3N2O3
Exact Mass 304.103477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKjx1gRMj7j
Name Methyl 4-(3,3-dimethylureido)-3-(2,2,2-trifluoroethyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15F3N2O3
InChI InChI=1S/C13H15F3N2O3/c1-18(2)12(20)17-10-5-4-8(11(19)21-3)6-9(10)7-13(14,15)16/h4-6H,7H2,1-3H3,(H,17,20)
InChIKey FEQRYHSXYXUGNC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201601136
Molecular Weight 304.269 g/mol
SMILES N(c1c(cc(C(=O)OC)cc1)CC(F)(F)F)C(=O)N(C)C
SPLASH splash10-004i-0490000000-497d91ff79cf317a57a7
Source of Spectrum ASC-359-527/SM33-3z
Wiley ID 1807803