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N-(1-Phenethyl-4-piperidyl)-2,2-dimethylpropionate
SpectraBase Compound ID GcwCxFbhoKM
InChI InChI=1S/C18H27NO2/c1-18(2,3)17(20)21-16-10-13-19(14-11-16)12-9-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3
InChIKey XJNOZZQSKFANSH-UHFFFAOYSA-N
Mol Weight 289.42 g/mol
Molecular Formula C18H27NO2
Exact Mass 289.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGoG1657z60
Name N-(1-Phenethyl-4-piperidyl)-2,2-dimethylpropionate
Classification Fentanyl side product
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 289.204179111 u
Formula C18H27NO2
InChI InChI=1S/C18H27NO2/c1-18(2,3)17(20)21-16-10-13-19(14-11-16)12-9-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3
InChIKey XJNOZZQSKFANSH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 289.419 g/mol
Nominal Mass 289 u
Quality 980
Retention Index 2005
SMILES C(C(OC1CCN(CCC2=CC=CC=C2)CC1)=O)(C)(C)C
SPLASH splash10-0002-4900000000-03355ad027f11cdb1e97
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-Phenethyl-4-piperidyl)pivalate 1-(2-phenylethyl)piperidin-4-yl 2,2-dimethylpropanoate
Technique GC/MS
Wiley ID DD2024_025162