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1-(4-Phenylpiperazin-1-yl)dodecan-1-one
SpectraBase Compound ID InEMDAFvjoY
InChI InChI=1S/C22H36N2O/c1-2-3-4-5-6-7-8-9-13-16-22(25)24-19-17-23(18-20-24)21-14-11-10-12-15-21/h10-12,14-15H,2-9,13,16-20H2,1H3
InChIKey SZTPACHPYKENQV-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H36N2O
Exact Mass 344.282764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4LT8hAFg1QO
Name 1-(4-Phenylpiperazin-1-yl)dodecan-1-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36N2O
InChI InChI=1S/C22H36N2O/c1-2-3-4-5-6-7-8-9-13-16-22(25)24-19-17-23(18-20-24)21-14-11-10-12-15-21/h10-12,14-15H,2-9,13,16-20H2,1H3
InChIKey SZTPACHPYKENQV-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.0c04203
Molecular Weight 344.543 g/mol
Reported Formula C22H36N2O
SMILES C(CCCCCCCCCCC)(=O)N1CCN(CC1)c1ccccc1
SPLASH splash10-001i-0900000000-5b8c648bec793418c9a6
Source of Spectrum A1-23-SM16-4xa
Thin-Layer Chromatography Rf = 0.5 (PE/EA, 5:1)
Wiley ID 1855016