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1-Benzyl-3-piperidone hydrochloride hydrate

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

1-Benzyl-3-piperidone hydrochloride hydrate
SpectraBase Compound ID 1tIYs1D52CU
InChI InChI=1S/C12H15NO.Cl.H2O/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11;;/h1-3,5-6H,4,7-10H2;;1H2
InChIKey ZVDZRHQRWQGJQJ-UHFFFAOYSA-N
Mol Weight 242.73 g/mol
Molecular Formula C12H17ClNO2
Exact Mass 242.094781 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID EkGfk5tSKTW
Name 1-Benzyl-3-piperidone hydrochloride hydrate
Source of Sample Aldrich
Catalog Number 153117
CAS Registry Number 50606-58-1
Classification Aromatic ketones
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18ClNO2
InChI InChI=1S/C12H15NO.Cl.H2O/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11;;/h1-3,5-6H,4,7-10H2;;1H2
InChIKey ZVDZRHQRWQGJQJ-UHFFFAOYSA-N
Purity 95%
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Mull
Wiley ID SIAL_FTIR_1_1614