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4-(4-Methoxyphenyl)butylamine, N-pentafluoropropionyl

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

4-(4-Methoxyphenyl)butylamine, N-pentafluoropropionyl
SpectraBase Compound ID Jk9QzCqRTMU
InChI InChI=1S/C14H16F5NO2/c1-22-11-7-5-10(6-8-11)4-2-3-9-20-12(21)13(15,16)14(17,18)19/h5-8H,2-4,9H2,1H3,(H,20,21)
InChIKey PEIIDYVCXNCOSI-UHFFFAOYSA-N
Mol Weight 325.28 g/mol
Molecular Formula C14H16F5NO2
Exact Mass 325.11012 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FpQN1ZFhSeQ
Name 4-(4-Methoxyphenyl)butylamine, N-pentafluoropropionyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 325.110119572 u
Formula C14H16F5NO2
InChI InChI=1S/C14H16F5NO2/c1-22-11-7-5-10(6-8-11)4-2-3-9-20-12(21)13(15,16)14(17,18)19/h5-8H,2-4,9H2,1H3,(H,20,21)
InChIKey PEIIDYVCXNCOSI-UHFFFAOYSA-N
Molecular Weight 325.279 g/mol
SMILES COC1=CC=C(CCCCNC(=O)C(F)(F)C(F)(F)F)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.822097