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4-Piperidineethanol, 1-[3-[4-(1,1-dimethylethyl)phenyl]-2-methylpropyl]-

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 Raman

4-Piperidineethanol, 1-[3-[4-(1,1-dimethylethyl)phenyl]-2-methylpropyl]-
SpectraBase Compound ID 1YiSvgNLTw2
InChI InChI=1S/C21H35NO/c1-17(16-22-12-9-18(10-13-22)11-14-23)15-19-5-7-20(8-6-19)21(2,3)4/h5-8,17-18,23H,9-16H2,1-4H3
InChIKey PXECSYDKPRDYEL-UHFFFAOYSA-N
Mol Weight 317.5 g/mol
Molecular Formula C21H35NO
Exact Mass 317.271865 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID C5Q9VOuKVMl
Name 4-Piperidineethanol, 1-[3-[4-(1,1-dimethylethyl)phenyl]-2-methylpropyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.271864750 u
Formula C21H35NO
InChI InChI=1S/C21H35NO/c1-17(16-22-12-9-18(10-13-22)11-14-23)15-19-5-7-20(8-6-19)21(2,3)4/h5-8,17-18,23H,9-16H2,1-4H3
InChIKey PXECSYDKPRDYEL-UHFFFAOYSA-N
SMILES OCCC1CCN(CC(CC2=CC=C(C=C2)C(C)(C)C)C)CC1
Spectrum/Structure Validation Score (Raman) 0.967285