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1-Methyl-4-(phenoxyacetyl)piperazine, monohydrochloride

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

1-Methyl-4-(phenoxyacetyl)piperazine, monohydrochloride
SpectraBase Compound ID ACsdWrREeUf
InChI InChI=1S/C13H18N2O2.ClH/c1-14-7-9-15(10-8-14)13(16)11-17-12-5-3-2-4-6-12;/h2-6H,7-11H2,1H3;1H
InChIKey VOVRILAHOBFBKJ-UHFFFAOYSA-N
Mol Weight 270.76 g/mol
Molecular Formula C13H19ClN2O2
Exact Mass 270.113506 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Ad8KRERNXM9
Name 1-Methyl-4-(phenoxyacetyl)piperazine, monohydrochloride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.113505558 u
Formula C13H19ClN2O2
InChI InChI=1S/C13H18N2O2.ClH/c1-14-7-9-15(10-8-14)13(16)11-17-12-5-3-2-4-6-12;/h2-6H,7-11H2,1H3;1H
InChIKey VOVRILAHOBFBKJ-UHFFFAOYSA-N
Molecular Weight 270.760 g/mol
Nominal Mass 270 u
SMILES Cl.C=1C(=CC=CC1)OCC(N1CCN(CC1)C)=O
Spectrum/Structure Validation Score (Raman) 0.889573