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trans-2-Benzyl-6-ethynyl-2,6-dimethyl-piperidine
SpectraBase Compound ID 20yqxJkCkR1
InChI InChI=1S/C16H21N/c1-4-15(2)11-8-12-16(3,17-15)13-14-9-6-5-7-10-14/h1,5-7,9-10,17H,8,11-13H2,2-3H3/t15-,16+/m1/s1
InChIKey WIOVKOCFTCHLRQ-CVEARBPZSA-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 Arlvozz8o19
Name trans-2-Benzyl-6-ethynyl-2,6-dimethyl-piperidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N
InChI InChI=1S/C16H21N/c1-4-15(2)11-8-12-16(3,17-15)13-14-9-6-5-7-10-14/h1,5-7,9-10,17H,8,11-13H2,2-3H3/t15-,16+/m1/s1
InChIKey WIOVKOCFTCHLRQ-CVEARBPZSA-N
Instrument Name Thermoquest Automass Multi
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0013.506
Molecular Weight 227.351 g/mol
SMILES N1[C@@](CCC[C@@]1(C)Cc1ccccc1)(C#C)C
SPLASH splash10-000f-9300000000-fe612f6b6f06704596ac
Source of Spectrum ARK-2012-56-9
Thin-Layer Chromatography Rf = 0.52 (CHCl3/Et2O, 2:1)
Wiley ID 1864611