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Imidazolidine, 4-acetylamino-1-benzyl-2,5-dioxo-4-trifluoromethyl-
SpectraBase Compound ID 13h3bJ7kiN1
InChI InChI=1S/C13H12F3N3O3/c1-8(20)17-12(13(14,15)16)10(21)19(11(22)18-12)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,17,20)(H,18,22)
InChIKey WRDNOIWBAFDHCI-UHFFFAOYSA-N
Mol Weight 315.25 g/mol
Molecular Formula C13H12F3N3O3
Exact Mass 315.083076 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Gurx1WeHzQE
Name Imidazolidine, 4-acetylamino-1-benzyl-2,5-dioxo-4-trifluoromethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 315.083075744 u
Formula C13H12F3N3O3
InChI InChI=1S/C13H12F3N3O3/c1-8(20)17-12(13(14,15)16)10(21)19(11(22)18-12)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,17,20)(H,18,22)
InChIKey WRDNOIWBAFDHCI-UHFFFAOYSA-N
Molecular Weight 315.252 g/mol
SMILES C(=O)(NC1(C(F)(F)F)NC(N(CC2=CC=CC=C2)C1=O)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970631