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(.+/-.)-p-methoxyamphetamine, N-pentafluoropropionyl-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(.+/-.)-p-methoxyamphetamine, N-pentafluoropropionyl-
SpectraBase Compound ID 333j0UeyO1r
InChI InChI=1S/C13H14F5NO2/c1-8(7-9-3-5-10(21-2)6-4-9)19-11(20)12(14,15)13(16,17)18/h3-6,8H,7H2,1-2H3,(H,19,20)
InChIKey ZOYSSHCIQMLZAN-UHFFFAOYSA-N
Mol Weight 311.25 g/mol
Molecular Formula C13H14F5NO2
Exact Mass 311.09447 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BCc462tss5x
Name (.+/-.)-p-methoxyamphetamine, N-pentafluoropropionyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.094469508 u
Formula C13H14F5NO2
InChI InChI=1S/C13H14F5NO2/c1-8(7-9-3-5-10(21-2)6-4-9)19-11(20)12(14,15)13(16,17)18/h3-6,8H,7H2,1-2H3,(H,19,20)
InChIKey ZOYSSHCIQMLZAN-UHFFFAOYSA-N
Molecular Weight 311.252 g/mol
SMILES C1=CC(=CC=C1CC(NC(C(C(F)(F)F)(F)F)=O)C)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.889074