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6-(o-Chlorophenyl)-5-nitro-2-piperidone

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

6-(o-Chlorophenyl)-5-nitro-2-piperidone
SpectraBase Compound ID KK3fdEQGYhc
InChI InChI=1S/C11H11ClN2O3/c12-8-4-2-1-3-7(8)11-9(14(16)17)5-6-10(15)13-11/h1-4,9,11H,5-6H2,(H,13,15)
InChIKey TYGMJKKENBLZGE-UHFFFAOYSA-N
Mol Weight 254.67 g/mol
Molecular Formula C11H11ClN2O3
Exact Mass 254.04582 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID HAB9tax7U0G
Name 6-(o-Chlorophenyl)-5-nitro-2-piperidone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.045819919 u
Formula C11H11ClN2O3
InChI InChI=1S/C11H11ClN2O3/c12-8-4-2-1-3-7(8)11-9(14(16)17)5-6-10(15)13-11/h1-4,9,11H,5-6H2,(H,13,15)
InChIKey TYGMJKKENBLZGE-UHFFFAOYSA-N
Molecular Weight 254.673 g/mol
SMILES N1C(CCC(C1C=1C(=CC=CC1)Cl)N(=O)=O)=O
Spectrum/Structure Validation Score (Raman) 0.838608