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1-Methyl-3-piperidyl cyclopentylphenylglycolate

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

1-Methyl-3-piperidyl cyclopentylphenylglycolate
SpectraBase Compound ID JuGTvHN9AS6
InChI InChI=1S/C19H27NO3/c1-20-13-7-12-17(14-20)23-18(21)19(22,16-10-5-6-11-16)15-8-3-2-4-9-15/h2-4,8-9,16-17,22H,5-7,10-14H2,1H3
InChIKey SEWHBJAHHOCKER-UHFFFAOYSA-N
Mol Weight 317.43 g/mol
Molecular Formula C19H27NO3
Exact Mass 317.199094 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B3S7h7wbQbu
Name 1-Methyl-3-piperidyl cyclopentylphenylglycolate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.199093730 u
Formula C19H27NO3
InChI InChI=1S/C19H27NO3/c1-20-13-7-12-17(14-20)23-18(21)19(22,16-10-5-6-11-16)15-8-3-2-4-9-15/h2-4,8-9,16-17,22H,5-7,10-14H2,1H3
InChIKey SEWHBJAHHOCKER-UHFFFAOYSA-N
Molecular Weight 317.429 g/mol
SMILES C(=O)(OC1CCCN(C1)C)C(C1=CC=CC=C1)(O)C1CCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.86588