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1-Acetoxy-1-phenyl-1-(4-hydroxycyclohexyl)-3-piperidinylpropane

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

1-Acetoxy-1-phenyl-1-(4-hydroxycyclohexyl)-3-piperidinylpropane
SpectraBase Compound ID 7zFKSaxr5y5
InChI InChI=1S/C22H33NO3/c1-18(24)26-22(19-8-4-2-5-9-19,20-10-12-21(25)13-11-20)14-17-23-15-6-3-7-16-23/h2,4-5,8-9,20-21,25H,3,6-7,10-17H2,1H3
InChIKey XZZJLSMDWMPUBY-UHFFFAOYSA-N
Mol Weight 359.5 g/mol
Molecular Formula C22H33NO3
Exact Mass 359.246044 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6N1Pcs0GRdG
Name 1-Acetoxy-1-phenyl-1-(4-hydroxycyclohexyl)-3-piperidinylpropane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.246043924 u
Formula C22H33NO3
InChI InChI=1S/C22H33NO3/c1-18(24)26-22(19-8-4-2-5-9-19,20-10-12-21(25)13-11-20)14-17-23-15-6-3-7-16-23/h2,4-5,8-9,20-21,25H,3,6-7,10-17H2,1H3
InChIKey XZZJLSMDWMPUBY-UHFFFAOYSA-N
Molecular Weight 359.510 g/mol
SMILES C(CCN1CCCCC1)(OC(=O)C)(C1CCC(CC1)O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.829378