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Methyl 4-methyl-2-(2-oxo-2-{[4-(trifluoromethyl)phenyl]amino}ethoxy)benzoate
SpectraBase Compound ID 3NXyPzPLVZC
InChI InChI=1S/C18H16F3NO4/c1-11-3-8-14(17(24)25-2)15(9-11)26-10-16(23)22-13-6-4-12(5-7-13)18(19,20)21/h3-9H,10H2,1-2H3,(H,22,23)
InChIKey BCICUARDNFAYFX-UHFFFAOYSA-N
Mol Weight 367.32 g/mol
Molecular Formula C18H16F3NO4
Exact Mass 367.103142 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID F7Yq57Zxl2y
Name Methyl 4-methyl-2-(2-oxo-2-{[4-(trifluoromethyl)phenyl]amino}ethoxy)benzoate
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 367.103142484 u
Formula C18H16F3NO4
InChI InChI=1S/C18H16F3NO4/c1-11-3-8-14(17(24)25-2)15(9-11)26-10-16(23)22-13-6-4-12(5-7-13)18(19,20)21/h3-9H,10H2,1-2H3,(H,22,23)
InChIKey BCICUARDNFAYFX-UHFFFAOYSA-N
Molecular Weight 367.324 g/mol
SMILES COC(=O)C=1C(OCC(NC2=CC=C(C=C2)C(F)(F)F)=O)=CC(C)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915671