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alpha-Phenethyl-o-(2-piperidinoethoxy)benzyl alcohol
SpectraBase Compound ID 5nrHskRocHb
InChI InChI=1S/C22H29NO2/c24-21(14-13-19-9-3-1-4-10-19)20-11-5-6-12-22(20)25-18-17-23-15-7-2-8-16-23/h1,3-6,9-12,21,24H,2,7-8,13-18H2
InChIKey IUKXXGXHFJWJHV-UHFFFAOYSA-N
Mol Weight 339.48 g/mol
Molecular Formula C22H29NO2
Exact Mass 339.219829 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 1VEMWEv40Wy
Name alpha-Phenethyl-o-(2-piperidinoethoxy)benzyl alcohol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.219829176 u
Formula C22H29NO2
InChI InChI=1S/C22H29NO2/c24-21(14-13-19-9-3-1-4-10-19)20-11-5-6-12-22(20)25-18-17-23-15-7-2-8-16-23/h1,3-6,9-12,21,24H,2,7-8,13-18H2
InChIKey IUKXXGXHFJWJHV-UHFFFAOYSA-N
Molecular Weight 339.479 g/mol
SMILES OC(CCC1=CC=CC=C1)C=1C=CC=CC1OCCN1CCCCC1
Spectrum/Structure Validation Score (Raman) 0.960348