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1-(4-Methoxyphenethyl)-4-piperidinamine, N-pentafluoropropionyl-
SpectraBase Compound ID ERvQPoMzfWg
InChI InChI=1S/C17H21F5N2O2/c1-26-14-4-2-12(3-5-14)6-9-24-10-7-13(8-11-24)23-15(25)16(18,19)17(20,21)22/h2-5,13H,6-11H2,1H3,(H,23,25)
InChIKey KMLHRCJGVYYGAP-UHFFFAOYSA-N
Mol Weight 380.36 g/mol
Molecular Formula C17H21F5N2O2
Exact Mass 380.152319 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KPa5neecDAJ
Name 1-(4-Methoxyphenethyl)-4-piperidinamine, N-pentafluoropropionyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.152318737 u
Formula C17H21F5N2O2
InChI InChI=1S/C17H21F5N2O2/c1-26-14-4-2-12(3-5-14)6-9-24-10-7-13(8-11-24)23-15(25)16(18,19)17(20,21)22/h2-5,13H,6-11H2,1H3,(H,23,25)
InChIKey KMLHRCJGVYYGAP-UHFFFAOYSA-N
Molecular Weight 380.359 g/mol
SMILES C1N(CCC(C1)NC(C(C(F)(F)F)(F)F)=O)CCC1=CC=C(C=C1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.852109