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1-(2-Phenylethyl)piperidin-4-yl-3-methoxy benzoate
SpectraBase Compound ID 8H2Qndgf3K2
InChI InChI=1S/C21H25NO3/c1-24-20-9-5-8-18(16-20)21(23)25-19-11-14-22(15-12-19)13-10-17-6-3-2-4-7-17/h2-9,16,19H,10-15H2,1H3
InChIKey BCRLZALBKLDZOH-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGo3gOpWYDY
Name 1-(2-Phenylethyl)piperidin-4-yl-3-methoxy benzoate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 339.183443666 u
Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-24-20-9-5-8-18(16-20)21(23)25-19-11-14-22(15-12-19)13-10-17-6-3-2-4-7-17/h2-9,16,19H,10-15H2,1H3
InChIKey BCRLZALBKLDZOH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 339.435 g/mol
Nominal Mass 339 u
Quality 1000
Retention Index 2800
SMILES C1(C(OC2CCN(CC2)CCC2=CC=CC=C2)=O)=CC(=CC=C1)OC
SPLASH splash10-000b-3890000000-ce400232ff173b456959
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_027146