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1-(2-Phenylethyl)piperidin-4-yl-3,4-methylenedioxyphenyl acetate
SpectraBase Compound ID IrZvQ5yOffG
InChI InChI=1S/C22H25NO4/c24-22(15-18-6-7-20-21(14-18)26-16-25-20)27-19-9-12-23(13-10-19)11-8-17-4-2-1-3-5-17/h1-7,14,19H,8-13,15-16H2
InChIKey MDJJLGLCMMNGCM-UHFFFAOYSA-N
Mol Weight 367.45 g/mol
Molecular Formula C22H25NO4
Exact Mass 367.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dk6k7t3c0bg
Name 1-(2-Phenylethyl)piperidin-4-yl-3,4-methylenedioxyphenyl acetate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 367.178358285 u
Formula C22H25NO4
InChI InChI=1S/C22H25NO4/c24-22(15-18-6-7-20-21(14-18)26-16-25-20)27-19-9-12-23(13-10-19)11-8-17-4-2-1-3-5-17/h1-7,14,19H,8-13,15-16H2
InChIKey MDJJLGLCMMNGCM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 367.445 g/mol
Nominal Mass 367 u
Quality 1000
Retention Index 2840
SMILES C1=2C(=CC=C(C2)CC(OC2CCN(CC2)CCC=2C=CC=CC2)=O)OCO1
SPLASH splash10-004i-2690000000-e50c1841e15345e745ca
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_027321