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1-Benzylpiperidin-4-yl 3-methyl benzoate
SpectraBase Compound ID GaLSiuSpjLY
InChI InChI=1S/C20H23NO2/c1-16-6-5-9-18(14-16)20(22)23-19-10-12-21(13-11-19)15-17-7-3-2-4-8-17/h2-9,14,19H,10-13,15H2,1H3
InChIKey QBMCJMMKUDBINA-UHFFFAOYSA-N
Mol Weight 309.41 g/mol
Molecular Formula C20H23NO2
Exact Mass 309.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IkoEQUUoro
Name 1-Benzylpiperidin-4-yl 3-methyl benzoate
Classification Fentanyl opioid side product
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 309.172878983 u
Formula C20H23NO2
InChI InChI=1S/C20H23NO2/c1-16-6-5-9-18(14-16)20(22)23-19-10-12-21(13-11-19)15-17-7-3-2-4-8-17/h2-9,14,19H,10-13,15H2,1H3
InChIKey QBMCJMMKUDBINA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 309.409 g/mol
Nominal Mass 309 u
Quality 971
Retention Index 2616
SMILES C1(C(OC2CCN(CC=3C=CC=CC3)CC2)=O)=CC(=CC=C1)C
SPLASH splash10-00sl-9600000000-8b970079647cd7deaafe
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_027367