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3-Carbamoyl-1-piperidineacetic acid, decyl ester

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

3-Carbamoyl-1-piperidineacetic acid, decyl ester
SpectraBase Compound ID 8bFZrmR02J7
InChI InChI=1S/C18H34N2O3/c1-2-3-4-5-6-7-8-9-13-23-17(21)15-20-12-10-11-16(14-20)18(19)22/h16H,2-15H2,1H3,(H2,19,22)
InChIKey QKOMQDBWULRYJQ-UHFFFAOYSA-N
Mol Weight 326.5 g/mol
Molecular Formula C18H34N2O3
Exact Mass 326.256943 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID FWnicYfoIKu
Name 3-Carbamoyl-1-piperidineacetic acid, decyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.256942960 u
Formula C18H34N2O3
InChI InChI=1S/C18H34N2O3/c1-2-3-4-5-6-7-8-9-13-23-17(21)15-20-12-10-11-16(14-20)18(19)22/h16H,2-15H2,1H3,(H2,19,22)
InChIKey QKOMQDBWULRYJQ-UHFFFAOYSA-N
Molecular Weight 326.481 g/mol
SMILES C1N(CCCC1C(N)=O)CC(OCCCCCCCCCC)=O
Spectrum/Structure Validation Score (Raman) 0.929055