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2-(4-Methylpiperazin-1-yl)-N- (3-trifluoromethylphenyl)acetamide

View entire compound with spectra: 1 NMR, and 1 FTIR

2-(4-Methylpiperazin-1-yl)-N- (3-trifluoromethylphenyl)acetamide
SpectraBase Compound ID FsSvY7jdmOB
InChI InChI=1S/C14H18F3N3O/c1-19-5-7-20(8-6-19)10-13(21)18-12-4-2-3-11(9-12)14(15,16)17/h2-4,9H,5-8,10H2,1H3,(H,18,21)
InChIKey BYJPVAVQOYZYRJ-UHFFFAOYSA-N
Mol Weight 301.31 g/mol
Molecular Formula C14H18F3N3O
Exact Mass 301.140197 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IL4WKnGRSLg
Name 2-(4-Methylpiperazin-1-yl)-N- (3-trifluoromethylphenyl)acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.140196700 u
Formula C14H18F3N3O
InChI InChI=1S/C14H18F3N3O/c1-19-5-7-20(8-6-19)10-13(21)18-12-4-2-3-11(9-12)14(15,16)17/h2-4,9H,5-8,10H2,1H3,(H,18,21)
InChIKey BYJPVAVQOYZYRJ-UHFFFAOYSA-N
Molecular Weight 301.313 g/mol
SMILES C1=CC(=CC(=C1)NC(CN1CCN(CC1)C)=O)C(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.869778