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Methyl 2-(4-(3,3-dimethylureido)-3-(2,2,2-trifluoroethyl)phenyl)acetate
SpectraBase Compound ID 8Ers7xKcu8M
InChI InChI=1S/C14H17F3N2O3/c1-19(2)13(21)18-11-5-4-9(7-12(20)22-3)6-10(11)8-14(15,16)17/h4-6H,7-8H2,1-3H3,(H,18,21)
InChIKey JTLOVMRLGHJTCH-UHFFFAOYSA-N
Mol Weight 318.3 g/mol
Molecular Formula C14H17F3N2O3
Exact Mass 318.119127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9pDMbpgHtZr
Name Methyl 2-(4-(3,3-dimethylureido)-3-(2,2,2-trifluoroethyl)phenyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17F3N2O3
InChI InChI=1S/C14H17F3N2O3/c1-19(2)13(21)18-11-5-4-9(7-12(20)22-3)6-10(11)8-14(15,16)17/h4-6H,7-8H2,1-3H3,(H,18,21)
InChIKey JTLOVMRLGHJTCH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201601136
Molecular Weight 318.296 g/mol
SMILES N(c1c(cc(CC(=O)OC)cc1)CC(F)(F)F)C(=O)N(C)C
SPLASH splash10-03di-0190000000-0d2afcedf8a77fa4af95
Source of Spectrum ASC-359-527/SM33-3aa
Wiley ID 1807771