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1-(2-Phenylethyl)piperidin-4-yl-2-methyl benzoate
SpectraBase Compound ID 9lNn0RutPyo
InChI InChI=1S/C21H25NO2/c1-17-7-5-6-10-20(17)21(23)24-19-12-15-22(16-13-19)14-11-18-8-3-2-4-9-18/h2-10,19H,11-16H2,1H3
InChIKey ZJQQIFSTMDXFRL-UHFFFAOYSA-N
Mol Weight 323.44 g/mol
Molecular Formula C21H25NO2
Exact Mass 323.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFQ029q2XnE
Name 1-(2-Phenylethyl)piperidin-4-yl-2-methyl benzoate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 323.188529047 u
Formula C21H25NO2
InChI InChI=1S/C21H25NO2/c1-17-7-5-6-10-20(17)21(23)24-19-12-15-22(16-13-19)14-11-18-8-3-2-4-9-18/h2-10,19H,11-16H2,1H3
InChIKey ZJQQIFSTMDXFRL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 323.436 g/mol
Nominal Mass 323 u
Quality 998
Retention Index 2645
SMILES C(C=1C(=CC=CC1)C)(OC1CCN(CC1)CCC1=CC=CC=C1)=O
SPLASH splash10-00lr-3890000000-18e9e0b8e1d044d41652
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_027152