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[2-(4-Benzyl-2,2-dimethyltetrahydropyran-4-yl)ethyl](4-fluorobenzyl)amine
SpectraBase Compound ID Ljp9TYqA7ty
InChI InChI=1S/C23H30FNO/c1-22(2)18-23(13-15-26-22,16-19-6-4-3-5-7-19)12-14-25-17-20-8-10-21(24)11-9-20/h3-11,25H,12-18H2,1-2H3
InChIKey IZRHCTRCYUGXAD-UHFFFAOYSA-N
Mol Weight 355.5 g/mol
Molecular Formula C23H30FNO
Exact Mass 355.231143 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6Qu9Ja865ZQ
Name [2-(4-Benzyl-2,2-dimethyltetrahydropyran-4-yl)ethyl](4-fluorobenzyl)amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.231142752 u
Formula C23H30FNO
InChI InChI=1S/C23H30FNO/c1-22(2)18-23(13-15-26-22,16-19-6-4-3-5-7-19)12-14-25-17-20-8-10-21(24)11-9-20/h3-11,25H,12-18H2,1-2H3
InChIKey IZRHCTRCYUGXAD-UHFFFAOYSA-N
Molecular Weight 355.497 g/mol
SMILES C1(CC(C)(C)OCC1)(CC=1C=CC=CC1)CCNCC=1C=CC(=CC1)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915354