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3,3-Dimethyl-1-[4-(5-methoxy-1,2,3,4-tetrahyronaphthalen-1-yl)-n-butyl]piperidine
SpectraBase Compound ID CCIOsqxnOd3
InChI InChI=1S/C22H35NO/c1-22(2)14-8-16-23(17-22)15-5-4-9-18-10-6-12-20-19(18)11-7-13-21(20)24-3/h7,11,13,18H,4-6,8-10,12,14-17H2,1-3H3
InChIKey WEUUSZNKIJMTMI-UHFFFAOYSA-N
Mol Weight 329.5 g/mol
Molecular Formula C22H35NO
Exact Mass 329.271865 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GxmFZK2qRAi
Name 3,3-Dimethyl-1-[4-(5-methoxy-1,2,3,4-tetrahyronaphthalen-1-yl)-N-butyl]piperidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.271864750 u
Formula C22H35NO
InChI InChI=1S/C22H35NO/c1-22(2)14-8-16-23(17-22)15-5-4-9-18-10-6-12-20-19(18)11-7-13-21(20)24-3/h7,11,13,18H,4-6,8-10,12,14-17H2,1-3H3
InChIKey WEUUSZNKIJMTMI-UHFFFAOYSA-N
Molecular Weight 329.528 g/mol
SMILES C12=C(C(CCCCN3CC(C)(C)CCC3)CCC1)C=CC=C2OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.916805