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N-benzylthio-1-piperidinecarboxamide

View entire compound with spectra: 2 NMR, 1 Raman, 1 UV-Vis, and 1 MS (GC)

N-benzylthio-1-piperidinecarboxamide
SpectraBase Compound ID 6fo1zQ6W2CL
InChI InChI=1S/C13H18N2S/c16-13(15-9-5-2-6-10-15)14-11-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,14,16)
InChIKey ODCBSMJLEWRRSJ-UHFFFAOYSA-N
Mol Weight 234.36 g/mol
Molecular Formula C13H18N2S
Exact Mass 234.11907 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Is3g1uRYN61
Name N-Benzylthio-1-piperidinecarboxamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.119069762 u
Formula C13H18N2S
InChI InChI=1S/C13H18N2S/c16-13(15-9-5-2-6-10-15)14-11-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,14,16)
InChIKey ODCBSMJLEWRRSJ-UHFFFAOYSA-N
Molecular Weight 234.361 g/mol
SMILES N(CC=1C=CC=CC1)C(N1CCCCC1)=S
Spectrum/Structure Validation Score (Raman) 0.93284