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1-[3-(4-ethylphenyl)prop-2-ynyl]piperidine
SpectraBase Compound ID HLdiZcZQ37t
InChI InChI=1S/C16H21N/c1-2-15-8-10-16(11-9-15)7-6-14-17-12-4-3-5-13-17/h8-11H,2-5,12-14H2,1H3
InChIKey RMZAFMRSKQHAFF-UHFFFAOYSA-N
Mol Weight 227.35 g/mol
Molecular Formula C16H21N
Exact Mass 227.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ehqwq3KiZVP
Name 1-[3-(4-ethylphenyl)prop-2-ynyl]piperidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N
InChI InChI=1S/C16H21N/c1-2-15-8-10-16(11-9-15)7-6-14-17-12-4-3-5-13-17/h8-11H,2-5,12-14H2,1H3
InChIKey RMZAFMRSKQHAFF-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/cjoc.202100145
Molecular Weight 227.351 g/mol
SMILES c1c(ccc(C#CCN2CCCCC2)c1)CC
SPLASH splash10-004i-1930000000-bca75a95d3220cb31441
Source of Spectrum CJC-39-SM26-Figure S21
Wiley ID 1870097