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Setiptiline

View entire compound with spectra: 1 FTIR

Setiptiline
SpectraBase Compound ID KXY3OJf784G
InChI InChI=1S/C19H19N/c1-20-11-10-18-16-8-4-2-6-14(16)12-15-7-3-5-9-17(15)19(18)13-20/h2-9H,10-13H2,1H3
InChIKey GVPIXRLYKVFFMK-UHFFFAOYSA-N
Mol Weight 261.37 g/mol
Molecular Formula C19H19N
Exact Mass 261.15175 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8RPgO6YS0IZ
Name Setiptiline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 261.151749616 u
Formula C19H19N
InChI InChI=1S/C19H19N/c1-20-11-10-18-16-8-4-2-6-14(16)12-15-7-3-5-9-17(15)19(18)13-20/h2-9H,10-13H2,1H3
InChIKey GVPIXRLYKVFFMK-UHFFFAOYSA-N
Molecular Weight 261.368 g/mol
SMILES C1C2=CC=CC=C2C2=C(C3=C1C=CC=C3)CCN(C2)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.848289